1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide

C25H21ClN2O3 — CID 23040452

IUPAC1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide
SMILESCc1cccc(C)c1NC(=O)c1c(-c2ccco2)n(-c2ccccc2Cl)c(C)cc1=O
InChIInChI=1S/C25H21ClN2O3/c1-15-8-6-9-16(2)23(15)27-25(30)22-20(29)14-17(3)28(19-11-5-4-10-18(19)26)24(22)21-12-7-13-31-21/h4-14H,1-3H3,(H,27,30)
InChIKeyXZHDLFMDXGQELH-UHFFFAOYSA-N
MW432.91 g/mol
LogP5.93
Rot. Bonds4

About 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide

1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide (PubChem CID 23040452) has the molecular formula C25H21ClN2O3 and a molecular weight of 432.91 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide
PubChem CID23040452
Molecular FormulaC25H21ClN2O3
Molecular Weight432.91 g/mol
Exact Mass432.12
IUPAC Name1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide
SMILESCc1cccc(C)c1NC(=O)c1c(-c2ccco2)n(-c2ccccc2Cl)c(C)cc1=O
InChIInChI=1S/C25H21ClN2O3/c1-15-8-6-9-16(2)23(15)27-25(30)22-20(29)14-17(3)28(19-11-5-4-10-18(19)26)24(22)21-12-7-13-31-21/h4-14H,1-3H3,(H,27,30)
InChIKeyXZHDLFMDXGQELH-UHFFFAOYSA-N
XLogP5.93
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.91
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-6-methyl-2-(2-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040451
1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-6-methyl-4-oxo-2-pyridin-4-ylpyridine-3-carboxamide
CID 23040214
N-(2-ethyl-6-methylphenyl)-2-(furan-2-yl)-6-methyl-4-oxo-1-phenylpyridine-3-carboxamide
CID 23040691
N-(2,6-dimethylphenyl)-6-methyl-2-(2-methylphenyl)-4-oxo-1-phenylpyridine-3-carboxamide
CID 23040476
N-(2-ethyl-6-methylphenyl)-6-methyl-1-(2-methylphenyl)-2-(4-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040245
2-(3-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-(2-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040411
N-(2,6-diethylphenyl)-6-methyl-1-(2-methylphenyl)-4-oxo-2-phenylpyridine-3-carboxamide
CID 14277824
1-benzyl-2-(furan-2-yl)-6-methyl-4-oxo-N-phenylpyridine-3-carboxamide
CID 14252505
2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040873
N-(2,3-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040772
N-(2,6-diethylphenyl)-6-methyl-1-(2-methylphenyl)-4-oxo-2-pyridin-4-ylpyridine-3-carboxamide
CID 23040058
N-(2-ethyl-6-methylphenyl)-6-methyl-1-(4-methylphenyl)-4-oxo-2-phenylpyridine-3-carboxamide
CID 23040521

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide?
The IUPAC name of 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide (CID 23040452) is 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide is Cc1cccc(C)c1NC(=O)c1c(-c2ccco2)n(-c2ccccc2Cl)c(C)cc1=O.
What is the InChIKey of 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide?
The InChIKey is XZHDLFMDXGQELH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21ClN2O3/c1-15-8-6-9-16(2)23(15)27-25(30)22-20(29)14-17(3)28(19-11-5-4-10-18(19)26)24(22)21-12-7-13-31-21/h4-14H,1-3H3,(H,27,30).
What are the key properties of 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide?
1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide has a molecular weight of 432.91 g/mol, XLogP of 5.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-(2,6-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 23040452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).