N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide

C16H24N2O2 — CID 47234721

IUPACN-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCC1CCC(C(C)C)C(NC(=O)c2ccc(=O)[nH]c2)C1
InChIInChI=1S/C16H24N2O2/c1-10(2)13-6-4-11(3)8-14(13)18-16(20)12-5-7-15(19)17-9-12/h5,7,9-11,13-14H,4,6,8H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyCISDPXXUUSMICW-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.57
Rot. Bonds3

About N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide

N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 47234721) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID47234721
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCC1CCC(C(C)C)C(NC(=O)c2ccc(=O)[nH]c2)C1
InChIInChI=1S/C16H24N2O2/c1-10(2)13-6-4-11(3)8-14(13)18-16(20)12-5-7-15(19)17-9-12/h5,7,9-11,13-14H,4,6,8H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyCISDPXXUUSMICW-UHFFFAOYSA-N
XLogP2.57
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-4-phenylbenzamide
CID 126621339
N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide
CID 63279324
4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 55662861
2-(methylamino)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 63552614
2,6-dichloro-N-[(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl]benzamide
CID 6932663
2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 61214396
N-(5-methyl-2-propan-2-ylcyclohexyl)thiadiazole-5-carboxamide
CID 47350810
5-bromo-N-(5-methyl-2-propan-2-ylcyclohexyl)pyridine-3-carboxamide
CID 63526340
N-(2-hydroxycycloheptyl)-6-oxo-1H-pyridine-3-carboxamide
CID 113394807
5-cyano-6-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyridine-2-carboxamide
CID 112830991
5-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)-1H-pyrazole-4-carboxamide
CID 63997417
5-chloro-2-fluoro-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 63483142

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide (CID 47234721) is N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide is CC1CCC(C(C)C)C(NC(=O)c2ccc(=O)[nH]c2)C1.
What is the InChIKey of N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is CISDPXXUUSMICW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-10(2)13-6-4-11(3)8-14(13)18-16(20)12-5-7-15(19)17-9-12/h5,7,9-11,13-14H,4,6,8H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide?
N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 47234721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).