1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide

C13H18N2O3 — CID 20574983

IUPAC1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
SMILESCc1cc(=O)n(C2CCCCC2)c(O)c1C(N)=O
InChIInChI=1S/C13H18N2O3/c1-8-7-10(16)15(9-5-3-2-4-6-9)13(18)11(8)12(14)17/h7,9,18H,2-6H2,1H3,(H2,14,17)
InChIKeyAESWCUGYOAIAJA-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.47
Rot. Bonds2

About 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide

1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide (PubChem CID 20574983) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
PubChem CID20574983
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
SMILESCc1cc(=O)n(C2CCCCC2)c(O)c1C(N)=O
InChIInChI=1S/C13H18N2O3/c1-8-7-10(16)15(9-5-3-2-4-6-9)13(18)11(8)12(14)17/h7,9,18H,2-6H2,1H3,(H2,14,17)
InChIKeyAESWCUGYOAIAJA-UHFFFAOYSA-N
XLogP1.47
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide (CID 20574983) is 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide is Cc1cc(=O)n(C2CCCCC2)c(O)c1C(N)=O.
What is the InChIKey of 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is AESWCUGYOAIAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-8-7-10(16)15(9-5-3-2-4-6-9)13(18)11(8)12(14)17/h7,9,18H,2-6H2,1H3,(H2,14,17).
What are the key properties of 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide?
1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 20574983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).