EcoDrugPlus


Keyword(s):	Human Metabolites
Molecule Category	Free-form
UNII	7DZ9SC8WCC
EPA CompTox	DTXSID7062035

Keyword(s):

Human Metabolites

Molecule Category

Free-form

UNII

7DZ9SC8WCC

EPA CompTox

DTXSID7062035


InChI Key	HAKKTZOUPCDMCN-UHFFFAOYSA-N
Smiles	CC(C)(C)C1CCNCC1
InChI	InChI=1S/C9H19N/c1-9(2,3)8-4-6-10-7-5-8/h8,10H,4-7H2,1-3H3

InChI Key

HAKKTZOUPCDMCN-UHFFFAOYSA-N

Smiles

CC(C)(C)C1CCNCC1

InChI

InChI=1S/C9H19N/c1-9(2,3)8-4-6-10-7-5-8/h8,10H,4-7H2,1-3H3

Property Name	Value
Molecular Formula	C9H19N1
Molecular Weight	141.15
AlogP	2.03
Hydrogen Bond Acceptor	1.0
Hydrogen Bond Donor	1.0
Polar Surface Area	12.03
Heavy Atoms	10.0

Property Name

Value

Molecular Formula

C9H19N1

Molecular Weight

141.15

AlogP

2.03

Hydrogen Bond Acceptor

1.0

Hydrogen Bond Donor

1.0

Polar Surface Area

12.03

Heavy Atoms

10.0

Resources	Reference
CAS NUMBER	1882-42-4
NORMAN SUSDAT
FDA SRS	7DZ9SC8WCC
PubChem	74661
ChemSpider	67236.0

Resources

Reference

CAS NUMBER

1882-42-4

NORMAN SUSDAT

FDA SRS

7DZ9SC8WCC

PubChem

74661

ChemSpider

67236.0

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

PIPERIDINE, 4-(1,1-DIMETHYLETHYL)-

Structure

Physicochemical Descriptors

Cross References