1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide

C20H18N2O3 — CID 110383127

IUPAC1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide
SMILESCc1ccc(COn2cccc(C(=O)Nc3ccccc3)c2=O)cc1
InChIInChI=1S/C20H18N2O3/c1-15-9-11-16(12-10-15)14-25-22-13-5-8-18(20(22)24)19(23)21-17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,21,23)
InChIKeyWHYIFEDKBUCHCU-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.04
Rot. Bonds5

About 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide

1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide (PubChem CID 110383127) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide
PubChem CID110383127
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Name1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide
SMILESCc1ccc(COn2cccc(C(=O)Nc3ccccc3)c2=O)cc1
InChIInChI=1S/C20H18N2O3/c1-15-9-11-16(12-10-15)14-25-22-13-5-8-18(20(22)24)19(23)21-17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,21,23)
InChIKeyWHYIFEDKBUCHCU-UHFFFAOYSA-N
XLogP3.04
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide?
The IUPAC name of 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide (CID 110383127) is 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide is Cc1ccc(COn2cccc(C(=O)Nc3ccccc3)c2=O)cc1.
What is the InChIKey of 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide?
The InChIKey is WHYIFEDKBUCHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-15-9-11-16(12-10-15)14-25-22-13-5-8-18(20(22)24)19(23)21-17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,21,23).
What are the key properties of 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide?
1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methylphenyl)methoxy]-2-oxo-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 110383127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).