N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide

C20H17ClN2O3 — CID 110382923

IUPACN-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCOc1ccc(Cn2cccc(C(=O)Nc3cccc(Cl)c3)c2=O)cc1
InChIInChI=1S/C20H17ClN2O3/c1-26-17-9-7-14(8-10-17)13-23-11-3-6-18(20(23)25)19(24)22-16-5-2-4-15(21)12-16/h2-12H,13H2,1H3,(H,22,24)
InChIKeyQDQJRBHBKAZQCE-UHFFFAOYSA-N
MW368.82 g/mol
LogP3.81
Rot. Bonds5

About N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide

N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 110382923) has the molecular formula C20H17ClN2O3 and a molecular weight of 368.82 g/mol. Its IUPAC name is N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
PubChem CID110382923
Molecular FormulaC20H17ClN2O3
Molecular Weight368.82 g/mol
Exact Mass368.09
IUPAC NameN-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCOc1ccc(Cn2cccc(C(=O)Nc3cccc(Cl)c3)c2=O)cc1
InChIInChI=1S/C20H17ClN2O3/c1-26-17-9-7-14(8-10-17)13-23-11-3-6-18(20(23)25)19(24)22-16-5-2-4-15(21)12-16/h2-12H,13H2,1H3,(H,22,24)
InChIKeyQDQJRBHBKAZQCE-UHFFFAOYSA-N
XLogP3.81
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.82
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide (CID 110382923) is N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide is COc1ccc(Cn2cccc(C(=O)Nc3cccc(Cl)c3)c2=O)cc1.
What is the InChIKey of N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
The InChIKey is QDQJRBHBKAZQCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O3/c1-26-17-9-7-14(8-10-17)13-23-11-3-6-18(20(23)25)19(24)22-16-5-2-4-15(21)12-16/h2-12H,13H2,1H3,(H,22,24).
What are the key properties of N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide?
N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 368.82 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110382923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).