1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide

C18H22N2O3 — CID 91955057

IUPAC1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1ccc(=O)n(-c2ccc(OC)cc2)c1
InChIInChI=1S/C18H22N2O3/c1-4-5-13(2)19-18(22)14-6-11-17(21)20(12-14)15-7-9-16(23-3)10-8-15/h6-13H,4-5H2,1-3H3,(H,19,22)
InChIKeyRFWAEJQEYUZLCX-UHFFFAOYSA-N
MW314.39 g/mol
LogP2.76
Rot. Bonds6

About 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide

1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide (PubChem CID 91955057) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide
PubChem CID91955057
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC Name1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1ccc(=O)n(-c2ccc(OC)cc2)c1
InChIInChI=1S/C18H22N2O3/c1-4-5-13(2)19-18(22)14-6-11-17(21)20(12-14)15-7-9-16(23-3)10-8-15/h6-13H,4-5H2,1-3H3,(H,19,22)
InChIKeyRFWAEJQEYUZLCX-UHFFFAOYSA-N
XLogP2.76
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91955026
methyl 2-[[1-(4-methoxyphenyl)-6-oxopyridine-3-carbonyl]amino]acetate
CID 91945548
N-cyclohexyl-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91945533
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91954145
1-(4-methoxyphenyl)-6-oxo-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 91945572
1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 97465078
1-(4-methoxyphenyl)-6-oxo-N-(1,3-thiazol-2-ylmethyl)pyridine-3-carboxamide
CID 91954993
N-methoxy-1-(4-methoxyphenyl)-N-methyl-6-oxopyridine-3-carboxamide
CID 91955056
N-butan-2-yl-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide
CID 4653931
5-[(4-acetylanilino)methyl]-1-(4-methoxyphenyl)pyridin-2-one
CID 56848111
6-methoxy-2-oxo-N-pentan-2-ylchromene-3-carboxamide
CID 133184087
N-pentan-2-ylnaphthalene-2-carboxamide
CID 15622075

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide (CID 91955057) is 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide is CCCC(C)NC(=O)c1ccc(=O)n(-c2ccc(OC)cc2)c1.
What is the InChIKey of 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide?
The InChIKey is RFWAEJQEYUZLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-4-5-13(2)19-18(22)14-6-11-17(21)20(12-14)15-7-9-16(23-3)10-8-15/h6-13H,4-5H2,1-3H3,(H,19,22).
What are the key properties of 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide?
1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide has a molecular weight of 314.39 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 91955057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).