1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide

C12H18N2O — CID 33379020

IUPAC1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide
SMILESN#CC1(C(=O)NCC2CCC2)CCCC1
InChIInChI=1S/C12H18N2O/c13-9-12(6-1-2-7-12)11(15)14-8-10-4-3-5-10/h10H,1-8H2,(H,14,15)
InChIKeyAKNRYWDGNJITKD-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.99
Rot. Bonds3

About 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide

1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide (PubChem CID 33379020) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide
PubChem CID33379020
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide
SMILESN#CC1(C(=O)NCC2CCC2)CCCC1
InChIInChI=1S/C12H18N2O/c13-9-12(6-1-2-7-12)11(15)14-8-10-4-3-5-10/h10H,1-8H2,(H,14,15)
InChIKeyAKNRYWDGNJITKD-UHFFFAOYSA-N
XLogP1.99
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyano-N-(dicyclopropylmethyl)cyclopentane-1-carboxamide
CID 61841438
1-cyano-N-[[1-(2-methylpropyl)cyclobutyl]methyl]cyclobutane-1-carboxamide
CID 71921172
1-cyano-N-(3-fluorocyclopentyl)cyclobutane-1-carboxamide
CID 126773685
1-cyano-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
CID 60718245
1-cyano-N-(3,3,3-trifluoropropyl)cyclopentane-1-carboxamide
CID 63226756
1-cyano-N-(4,4,4-trifluorobutyl)cyclopentane-1-carboxamide
CID 79039386
1-cyano-N-(2,2-difluoroethyl)cyclopentane-1-carboxamide
CID 79078847
1-cyano-N-(5,5,5-trifluoropentyl)cyclopentane-1-carboxamide
CID 113322121
1-cyano-N-(2-fluoroethyl)-3-methylcyclobutane-1-carboxamide
CID 130478174
1-cyano-N-cyclopentylcyclopentane-1-carboxamide
CID 33722085
N-(2-cyanoethyl)cyclopentanecarboxamide
CID 22263151
1-methyl-N-(4-methylpentyl)cyclopentane-1-carboxamide
CID 56808154

Frequently Asked Questions

What is the IUPAC name of 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide (CID 33379020) is 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide is N#CC1(C(=O)NCC2CCC2)CCCC1.
What is the InChIKey of 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide?
The InChIKey is AKNRYWDGNJITKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-9-12(6-1-2-7-12)11(15)14-8-10-4-3-5-10/h10H,1-8H2,(H,14,15).
What are the key properties of 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide?
1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide has a molecular weight of 206.29 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N-(cyclobutylmethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 33379020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).