5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide

C13H15N3O — CID 63718941

IUPAC5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCC2CCCC2)nc1
InChIInChI=1S/C13H15N3O/c14-7-11-5-6-12(15-9-11)13(17)16-8-10-3-1-2-4-10/h5-6,9-10H,1-4,8H2,(H,16,17)
InChIKeyITWGVIVNYUXAHQ-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.87
Rot. Bonds3

About 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide

5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide (PubChem CID 63718941) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide
PubChem CID63718941
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCC2CCCC2)nc1
InChIInChI=1S/C13H15N3O/c14-7-11-5-6-12(15-9-11)13(17)16-8-10-3-1-2-4-10/h5-6,9-10H,1-4,8H2,(H,16,17)
InChIKeyITWGVIVNYUXAHQ-UHFFFAOYSA-N
XLogP1.87
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(bromomethyl)cyclohexyl]methyl]-5-cyanopyridine-2-carboxamide
CID 114317417
5-cyano-N-(3-ethylcyclohexyl)pyridine-2-carboxamide
CID 64748832
5-cyano-N-prop-2-ynylpyridine-2-carboxamide
CID 63717306
5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide
CID 129002375
4-(5-cyano-2-pyridinyl)-N-(cyclopentylmethyl)piperazine-1-carboxamide
CID 47069365
5-cyano-N-[(1-methoxycyclobutyl)methyl]pyridine-2-carboxamide
CID 113362666
5-chloro-N-(cyclohexylmethyl)pyrazine-2-carboxamide
CID 107236593
N-but-2-ynyl-5-cyanopyridine-2-carboxamide
CID 115866853
N-(cyclopentylmethyl)-5-(N'-hydroxycarbamimidoyl)pyridine-2-carboxamide
CID 77005094
5-cyano-N-[(1-methylcyclohexyl)methyl]pyridine-2-carboxamide
CID 103753315
5-amino-N-(cyclopropylmethyl)pyridine-2-carboxamide
CID 81319676
5-cyano-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)pyridine-2-carboxamide
CID 63719130

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide (CID 63718941) is 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide is N#Cc1ccc(C(=O)NCC2CCCC2)nc1.
What is the InChIKey of 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide?
The InChIKey is ITWGVIVNYUXAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c14-7-11-5-6-12(15-9-11)13(17)16-8-10-3-1-2-4-10/h5-6,9-10H,1-4,8H2,(H,16,17).
What are the key properties of 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide?
5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(cyclopentylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 63718941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).