3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide

C16H18N2OS — CID 119708564

IUPAC3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2cccc(-c3cccs3)c2)C1
InChIInChI=1S/C16H18N2OS/c17-13-7-6-12(9-13)16(19)18-14-4-1-3-11(10-14)15-5-2-8-20-15/h1-5,8,10,12-13H,6-7,9,17H2,(H,18,19)
InChIKeyFGPOWIQTLDOTEE-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.48
Rot. Bonds3

About 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide

3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide (PubChem CID 119708564) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide
PubChem CID119708564
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC Name3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2cccc(-c3cccs3)c2)C1
InChIInChI=1S/C16H18N2OS/c17-13-7-6-12(9-13)16(19)18-14-4-1-3-11(10-14)15-5-2-8-20-15/h1-5,8,10,12-13H,6-7,9,17H2,(H,18,19)
InChIKeyFGPOWIQTLDOTEE-UHFFFAOYSA-N
XLogP3.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
CID 56906171
(2S,4S)-2-methyl-N-(3-thiophen-2-ylphenyl)piperidine-4-carboxamide;hydrochloride
CID 120620482
4-[(3-thiophen-2-ylphenyl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 122078651
N'-(3-thiophen-2-ylphenyl)oxamide
CID 151856111
3-amino-N-(3-pyrrol-1-ylphenyl)cyclopentane-1-carboxamide
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3-amino-N-[3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119808886
3-amino-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]cyclopentane-1-carboxamide
CID 119699623
3-amino-N-thiophen-3-ylcyclopentane-1-carboxamide
CID 66350210
3-amino-N-[3-(1,3-dioxolan-2-yl)phenyl]cyclopentane-1-carboxamide
CID 106911930
3-amino-N-[3-(difluoromethoxy)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119707736
N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide
CID 79462712
3-amino-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119856940

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide (CID 119708564) is 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide is NC1CCC(C(=O)Nc2cccc(-c3cccs3)c2)C1.
What is the InChIKey of 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide?
The InChIKey is FGPOWIQTLDOTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c17-13-7-6-12(9-13)16(19)18-14-4-1-3-11(10-14)15-5-2-8-20-15/h1-5,8,10,12-13H,6-7,9,17H2,(H,18,19).
What are the key properties of 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide?
3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide has a molecular weight of 286.40 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-thiophen-2-ylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119708564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).