N-(2-cyanocyclopentyl)-3-phenylpropanamide

C15H18N2O — CID 62961970

IUPACN-(2-cyanocyclopentyl)-3-phenylpropanamide
SMILESN#CC1CCCC1NC(=O)CCc1ccccc1
InChIInChI=1S/C15H18N2O/c16-11-13-7-4-8-14(13)17-15(18)10-9-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-10H2,(H,17,18)
InChIKeyKLQRVOQOACNUJX-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.43
Rot. Bonds4

About N-(2-cyanocyclopentyl)-3-phenylpropanamide

N-(2-cyanocyclopentyl)-3-phenylpropanamide (PubChem CID 62961970) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2-cyanocyclopentyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(2-cyanocyclopentyl)-3-phenylpropanamide
PubChem CID62961970
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-(2-cyanocyclopentyl)-3-phenylpropanamide
SMILESN#CC1CCCC1NC(=O)CCc1ccccc1
InChIInChI=1S/C15H18N2O/c16-11-13-7-4-8-14(13)17-15(18)10-9-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-10H2,(H,17,18)
InChIKeyKLQRVOQOACNUJX-UHFFFAOYSA-N
XLogP2.43
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(2-cyanocyclopentyl)-4-phenylbutanamide
CID 63323965
N-(2-cyanocyclopentyl)-2-(2-hydroxyphenyl)acetamide
CID 79602744
benzyl N-[(1S,2S)-2-cyanocyclopentyl]carbamate
CID 23636183
2-amino-N-(2-cyanocyclopentyl)-3-phenylpropanamide
CID 62962908
N-(2-tert-butylcyclohexyl)-3-phenylpropanamide
CID 17147377
N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]-3-phenylpropanamide
CID 76978572
2-[3-(4-phenylphenyl)propanoylamino]cyclopentane-1-carboxylic acid
CID 126584625
N-[(1R,2R)-2-cyanocyclohexyl]benzamide
CID 10656966
N-(2-bromocyclopentyl)-4-phenylbutanamide
CID 80663026
2-(3-phenylpropylamino)cyclohexane-1-carbonitrile
CID 62742230
N-(2-cyanocyclopentyl)-4-(methylamino)butanamide
CID 62961468
2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide
CID 1011315

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanocyclopentyl)-3-phenylpropanamide?
The IUPAC name of N-(2-cyanocyclopentyl)-3-phenylpropanamide (CID 62961970) is N-(2-cyanocyclopentyl)-3-phenylpropanamide.
What is the SMILES notation for N-(2-cyanocyclopentyl)-3-phenylpropanamide?
The canonical SMILES for N-(2-cyanocyclopentyl)-3-phenylpropanamide is N#CC1CCCC1NC(=O)CCc1ccccc1.
What is the InChIKey of N-(2-cyanocyclopentyl)-3-phenylpropanamide?
The InChIKey is KLQRVOQOACNUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c16-11-13-7-4-8-14(13)17-15(18)10-9-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-10H2,(H,17,18).
What are the key properties of N-(2-cyanocyclopentyl)-3-phenylpropanamide?
N-(2-cyanocyclopentyl)-3-phenylpropanamide has a molecular weight of 242.32 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanocyclopentyl)-3-phenylpropanamide is sourced from PubChem (CID 62961970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).