N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide

C18H25N3O3 — CID 4313519

IUPACN-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC1(C(=O)NC2CCCC2)CCCCC1)c1ccc(=O)[nH]c1
InChIInChI=1S/C18H25N3O3/c22-15-9-8-13(12-19-15)16(23)21-18(10-4-1-5-11-18)17(24)20-14-6-2-3-7-14/h8-9,12,14H,1-7,10-11H2,(H,19,22)(H,20,24)(H,21,23)
InChIKeyHKLPDLOIZZEACR-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.87
Rot. Bonds4

About N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide

N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 4313519) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID4313519
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC NameN-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC1(C(=O)NC2CCCC2)CCCCC1)c1ccc(=O)[nH]c1
InChIInChI=1S/C18H25N3O3/c22-15-9-8-13(12-19-15)16(23)21-18(10-4-1-5-11-18)17(24)20-14-6-2-3-7-14/h8-9,12,14H,1-7,10-11H2,(H,19,22)(H,20,24)(H,21,23)
InChIKeyHKLPDLOIZZEACR-UHFFFAOYSA-N
XLogP1.87
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxycycloheptyl)-6-oxo-1H-pyridine-3-carboxamide
CID 113394807
N-[2-[[1-(cyclopentylcarbamoyl)cyclohexyl]amino]-2-oxoethyl]benzamide
CID 3236722
4-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 60808216
N-[[1-(bromomethyl)cyclohexyl]methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 114041003
N-(oxan-3-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 63361586
N-cyclopentyl-1-[[2-(1H-indol-3-yl)acetyl]amino]cyclohexane-1-carboxamide
CID 3993913
N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide
CID 63279324
6-oxo-1H-pyridine-3-carbohydrazide
CID 11051863
N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 47363948
N-cyclohexyl-4-(6-oxo-1H-pyridin-3-yl)piperazine-1-carboxamide
CID 110749250
4-amino-N-cyclohexylbenzamide;hydrochloride
CID 83814043
1-(6-oxo-1H-pyridine-3-carbonyl)azepane-2-carboxylic acid
CID 64560700

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide (CID 4313519) is N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide is O=C(NC1(C(=O)NC2CCCC2)CCCCC1)c1ccc(=O)[nH]c1.
What is the InChIKey of N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is HKLPDLOIZZEACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c22-15-9-8-13(12-19-15)16(23)21-18(10-4-1-5-11-18)17(24)20-14-6-2-3-7-14/h8-9,12,14H,1-7,10-11H2,(H,19,22)(H,20,24)(H,21,23).
What are the key properties of N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide?
N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 1.87, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopentylcarbamoyl)cyclohexyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 4313519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).