EcoDrugPlus


Keyword(s):	Surfactants
Molecule Category	Free-form
EPA CompTox	DTXSID60880380

Keyword(s):

Surfactants

Molecule Category

Free-form

EPA CompTox

DTXSID60880380


InChI Key	UHPXXKLAACDXGS-UHFFFAOYSA-N
Smiles	OCCNC(CCCCCCCCCCCCCC)=O
InChI	InChI=1S/C17H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(20)18-15-16-19/h19H,2-16H2,1H3,(H,18,20)

InChI Key

UHPXXKLAACDXGS-UHFFFAOYSA-N

Smiles

OCCNC(CCCCCCCCCCCCCC)=O

InChI

InChI=1S/C17H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(20)18-15-16-19/h19H,2-16H2,1H3,(H,18,20)

Property Name	Value
Molecular Formula	C17H35NO2
Molecular Weight	285.27
AlogP	5.03
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	15.0
Polar Surface Area	52.82
Heavy Atoms	20.0

Property Name

Value

Molecular Formula

C17H35NO2

Molecular Weight

285.27

AlogP

5.03

Hydrogen Bond Acceptor

2.0

Hydrogen Bond Donor

2.0

Number of Rotational Bond

15.0

Polar Surface Area

52.82

Heavy Atoms

20.0

Resources	Reference
CAS NUMBER	72623-73-5
NORMAN SUSDAT
PubChem	14455157
ChemSpider	13538073.0

Resources

Reference

CAS NUMBER

72623-73-5

NORMAN SUSDAT

PubChem

14455157

ChemSpider

13538073.0

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, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025

N1 C15 ALKANOLAMIDE

Structure

Physicochemical Descriptors

Cross References