2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide

C21H23N3O — CID 7516068

IUPAC2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide
SMILESN#CC1(NC(=O)CNC(c2ccccc2)c2ccccc2)CCCC1
InChIInChI=1S/C21H23N3O/c22-16-21(13-7-8-14-21)24-19(25)15-23-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-12,20,23H,7-8,13-15H2,(H,24,25)
InChIKeyZEFVUMXOESYUNI-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.32
Rot. Bonds6

About 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide

2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide (PubChem CID 7516068) has the molecular formula C21H23N3O and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide
PubChem CID7516068
Molecular FormulaC21H23N3O
Molecular Weight333.44 g/mol
Exact Mass333.18
IUPAC Name2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide
SMILESN#CC1(NC(=O)CNC(c2ccccc2)c2ccccc2)CCCC1
InChIInChI=1S/C21H23N3O/c22-16-21(13-7-8-14-21)24-19(25)15-23-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-12,20,23H,7-8,13-15H2,(H,24,25)
InChIKeyZEFVUMXOESYUNI-UHFFFAOYSA-N
XLogP3.32
TPSA64.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (2S)-2-hydroxy-2-phenylacetate
CID 7834274
N-(1-cyanocyclohexyl)-2,2-diphenylacetamide
CID 78830716
N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide
CID 51073006
N-(1-cyanocycloheptyl)-2-phenylsulfanylacetamide
CID 47149296
N-(1-cyanocyclopentyl)-2-[[(S)-[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]amino]acetamide
CID 9126261
N-(1-cyanocyclohexyl)-3-oxo-3-phenylpropanamide
CID 110473191
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (2S)-2-phenyl-2-phenylsulfanylacetate
CID 8821271
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (2R)-2-phenyl-2-phenylsulfanylacetate
CID 8821272
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (2R,3R)-3-methyl-2-phenylpentanoate
CID 7773143
N-(1-cyanocyclopentyl)-2-(dibenzylamino)acetamide
CID 51170595
2-[1-(3-chloro-4-fluorophenyl)ethylamino]-N-(1-cyanocyclopentyl)acetamide
CID 75442811
2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
CID 46603209

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide?
The IUPAC name of 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide (CID 7516068) is 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide is N#CC1(NC(=O)CNC(c2ccccc2)c2ccccc2)CCCC1.
What is the InChIKey of 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide?
The InChIKey is ZEFVUMXOESYUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O/c22-16-21(13-7-8-14-21)24-19(25)15-23-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-12,20,23H,7-8,13-15H2,(H,24,25).
What are the key properties of 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide?
2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide has a molecular weight of 333.44 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide is sourced from PubChem (CID 7516068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).