N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide

C16H18N2O4 — CID 91955026

IUPACN-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
SMILESCOc1ccc(-n2cc(C(=O)NCC(C)O)ccc2=O)cc1
InChIInChI=1S/C16H18N2O4/c1-11(19)9-17-16(21)12-3-8-15(20)18(10-12)13-4-6-14(22-2)7-5-13/h3-8,10-11,19H,9H2,1-2H3,(H,17,21)
InChIKeyQOMNKKCGKIDAGX-UHFFFAOYSA-N
MW302.33 g/mol
LogP0.96
Rot. Bonds5

About N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide

N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide (PubChem CID 91955026) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
PubChem CID91955026
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
SMILESCOc1ccc(-n2cc(C(=O)NCC(C)O)ccc2=O)cc1
InChIInChI=1S/C16H18N2O4/c1-11(19)9-17-16(21)12-3-8-15(20)18(10-12)13-4-6-14(22-2)7-5-13/h3-8,10-11,19H,9H2,1-2H3,(H,17,21)
InChIKeyQOMNKKCGKIDAGX-UHFFFAOYSA-N
XLogP0.96
TPSA80.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[[1-(4-methoxyphenyl)-6-oxopyridine-3-carbonyl]amino]acetate
CID 91945548
1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide
CID 91955057
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91954145
1-(4-methoxyphenyl)-6-oxo-N-(1,3-thiazol-2-ylmethyl)pyridine-3-carboxamide
CID 91954993
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
N-methoxy-1-(4-methoxyphenyl)-N-methyl-6-oxopyridine-3-carboxamide
CID 91955056
N-cyclohexyl-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91945533
3-(4-methoxyphenyl)-N-(2-methylpropyl)-4-oxoquinazoline-7-carboxamide
CID 39314202
5-[(4-acetylanilino)methyl]-1-(4-methoxyphenyl)pyridin-2-one
CID 56848111
N-(3-amino-2-hydroxy-3-oxopropyl)-4-methoxybenzamide
CID 107260916
N-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-6-oxo-1-phenylpyridine-3-carboxamide
CID 71600843

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide (CID 91955026) is N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide is COc1ccc(-n2cc(C(=O)NCC(C)O)ccc2=O)cc1.
What is the InChIKey of N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide?
The InChIKey is QOMNKKCGKIDAGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-11(19)9-17-16(21)12-3-8-15(20)18(10-12)13-4-6-14(22-2)7-5-13/h3-8,10-11,19H,9H2,1-2H3,(H,17,21).
What are the key properties of N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide?
N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 0.96, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 91955026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).