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

C15H24N2O3 — CID 57161202

IUPAC2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide
SMILESCCCCCCCCn1c(O)c(C(N)=O)c(C)cc1=O
InChIInChI=1S/C15H24N2O3/c1-3-4-5-6-7-8-9-17-12(18)10-11(2)13(14(16)19)15(17)20/h10,20H,3-9H2,1-2H3,(H2,16,19)
InChIKeyCVVWYHVOTLXQEF-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.32
Rot. Bonds8

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

2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide (PubChem CID 57161202) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide
PubChem CID57161202
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide
SMILESCCCCCCCCn1c(O)c(C(N)=O)c(C)cc1=O
InChIInChI=1S/C15H24N2O3/c1-3-4-5-6-7-8-9-17-12(18)10-11(2)13(14(16)19)15(17)20/h10,20H,3-9H2,1-2H3,(H2,16,19)
InChIKeyCVVWYHVOTLXQEF-UHFFFAOYSA-N
XLogP2.32
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-Pyridinecarboxamide, 1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-
CID 120131
5-Acetyl-1-butyl-6-hydroxy-4-methylpyridin-2-one
CID 12529532
2-Hydroxy-4-methyl-1-(2-methylpropyl)-6-oxopyridine-3-carboxamide
CID 15131400
2-Hydroxy-4-methyl-6-oxo-1-propylpyridine-3-carboxamide
CID 15216538
1-Butyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
CID 15216539
2-Hydroxy-4-methyl-1-octyl-6-oxo-1,6-dihydropyridine-3-carbonitrile
CID 15651620
6-Hydroxy-4,5-dimethyl-1-octylpyridin-2-one
CID 20541701
2-Hydroxy-4-methyl-6-oxo-1-propan-2-ylpyridine-3-carboxamide
CID 20574978
1-Cyclohexyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
CID 20574983
1-Butyl-4-ethyl-2-hydroxy-6-oxopyridine-3-carboxamide
CID 22761577
1-(2-Ethylhexyl)-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
CID 23338597
2-Hydroxy-1-(3-methoxypropyl)-4-methyl-6-oxopyridine-3-carboxamide
CID 23338643

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide (CID 57161202) is 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide is CCCCCCCCn1c(O)c(C(N)=O)c(C)cc1=O.
What is the InChIKey of 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide?
The InChIKey is CVVWYHVOTLXQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-3-4-5-6-7-8-9-17-12(18)10-11(2)13(14(16)19)15(17)20/h10,20H,3-9H2,1-2H3,(H2,16,19).
What are the key properties of 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide?
2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 2.32, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methyl-1-octyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 57161202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).