1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide

C16H18N2O2 — CID 110693057

IUPAC1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(=O)n(C)c2)cc1
InChIInChI=1S/C16H18N2O2/c1-11(2)12-4-7-14(8-5-12)17-16(20)13-6-9-15(19)18(3)10-13/h4-11H,1-3H3,(H,17,20)
InChIKeyREVDTNQVBRXSGW-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.76
Rot. Bonds3

About 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide

1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 110693057) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
PubChem CID110693057
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(=O)n(C)c2)cc1
InChIInChI=1S/C16H18N2O2/c1-11(2)12-4-7-14(8-5-12)17-16(20)13-6-9-15(19)18(3)10-13/h4-11H,1-3H3,(H,17,20)
InChIKeyREVDTNQVBRXSGW-UHFFFAOYSA-N
XLogP2.76
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
1-N,3-N,5-N-tris(4-propan-2-ylphenyl)benzene-1,3,5-tricarboxamide
CID 67992142
1-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-6-oxopyridine-3-carboxamide
CID 110693106
1-[(2-chlorophenyl)methyl]-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 8671405
4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
CID 47341998
N-(3-acetylphenyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 110693091
N-[4-[2-(cyclopropylamino)-2-oxoethyl]phenyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 131895570
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-6-oxopyridine-3-carboxamide
CID 110693119
4-(ethylamino)-N-(4-propan-2-ylphenyl)benzamide
CID 62171719
3-chloro-4-fluoro-N-(4-propan-2-ylphenyl)benzamide
CID 121261386
2-methyl-N-[4-[(4-propan-2-ylbenzoyl)amino]phenyl]benzamide
CID 17251708
4-(diethylamino)-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
CID 51094945

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide (CID 110693057) is 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide is CC(C)c1ccc(NC(=O)c2ccc(=O)n(C)c2)cc1.
What is the InChIKey of 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
The InChIKey is REVDTNQVBRXSGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11(2)12-4-7-14(8-5-12)17-16(20)13-6-9-15(19)18(3)10-13/h4-11H,1-3H3,(H,17,20).
What are the key properties of 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-oxo-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 110693057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).