EcoDrugPlus


Keyword(s):	Human Metabolites
Molecule Category	Free-form
UNII	L928S82LXO
EPA CompTox	DTXSID90959614

Keyword(s):

Human Metabolites

Molecule Category

Free-form

UNII

L928S82LXO

EPA CompTox

DTXSID90959614


InChI Key	IHBSVVZENGBQDY-BBWFWOEESA-N
Smiles	C=1C=CC2=C(C1)CC3N(C)CCC24CCCCC34
InChI	InChI=1/C17H23N/c1-18-11-10-17-9-5-4-8-15(17)16(18)12-13-6-2-3-7-14(13)17/h2-3,6-7,15-16H,4-5,8-12H2,1H3

InChI Key

IHBSVVZENGBQDY-BBWFWOEESA-N

Smiles

C=1C=CC2=C(C1)CC3N(C)CCC24CCCCC34

InChI

InChI=1/C17H23N/c1-18-11-10-17-9-5-4-8-15(17)16(18)12-13-6-2-3-7-14(13)17/h2-3,6-7,15-16H,4-5,8-12H2,1H3

Property Name	Value
Molecular Formula	C17H23N
Molecular Weight	241.18
AlogP	3.37
Hydrogen Bond Acceptor	1.0
Polar Surface Area	3.24
Heavy Atoms	18.0

Property Name

Value

Molecular Formula

C17H23N

Molecular Weight

241.18

AlogP

3.37

Hydrogen Bond Acceptor

1.0

Polar Surface Area

3.24

Heavy Atoms

18.0

Resources	Reference
CAS NUMBER	3882-38-0
NORMAN SUSDAT
FDA SRS	L928S82LXO
PubChem	5462509

Resources

Reference

CAS NUMBER

3882-38-0

NORMAN SUSDAT

FDA SRS

L928S82LXO

PubChem

5462509

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, Volume 54, Issue D1, 6 January 2026, Pages D1397–D1404, https://doi.org/10.1093/nar/gkaf1251

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 23^rd March 2026

N-METHYLMORPHINAN

Structure

Physicochemical Descriptors

Cross References