N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide

C23H20N4O4 — CID 53157132

IUPACN-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
SMILESCOc1cccc(NC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3-c2ccc(C)cc2)c1
InChIInChI=1S/C23H20N4O4/c1-14-7-9-17(10-8-14)27-20-19(22(29)26(2)23(27)30)11-15(13-24-20)21(28)25-16-5-4-6-18(12-16)31-3/h4-13H,1-3H3,(H,25,28)
InChIKeyWODNTBZVHBTNML-UHFFFAOYSA-N
MW416.44 g/mol
LogP2.65
Rot. Bonds4

About N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide

N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide (PubChem CID 53157132) has the molecular formula C23H20N4O4 and a molecular weight of 416.44 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
PubChem CID53157132
Molecular FormulaC23H20N4O4
Molecular Weight416.44 g/mol
Exact Mass416.15
IUPAC NameN-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
SMILESCOc1cccc(NC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3-c2ccc(C)cc2)c1
InChIInChI=1S/C23H20N4O4/c1-14-7-9-17(10-8-14)27-20-19(22(29)26(2)23(27)30)11-15(13-24-20)21(28)25-16-5-4-6-18(12-16)31-3/h4-13H,1-3H3,(H,25,28)
InChIKeyWODNTBZVHBTNML-UHFFFAOYSA-N
XLogP2.65
TPSA95.22 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3,4-dimethoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 53157135
N-(2-fluoro-5-methylphenyl)-1-(4-methoxyphenyl)-3-methyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 53157118
N-(4-fluoro-3-methylphenyl)-3-methyl-2,4-dioxo-1-phenylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 53157091
N-[(1S)-1-(4-fluorophenyl)ethyl]-1-(4-methoxyphenyl)-3-methyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 95099108
N-(3-methoxyphenyl)-2-[(4-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109256295
2-N,5-N-bis(3-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1368781
N-(3-methoxyphenyl)-1-(4-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 942417
N-(6-methoxy-1,3-benzothiazol-2-yl)-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 24631901
N-[4-(dimethylamino)phenyl]-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 78840610
4-hydroxy-1-(3-methoxyphenyl)-N-(3-methylphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 54727123
5-N-(3-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 47460212
2-(3-methoxyanilino)-6,8-dimethylpteridin-7-one
CID 3233678

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide (CID 53157132) is N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide is COc1cccc(NC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3-c2ccc(C)cc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is WODNTBZVHBTNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O4/c1-14-7-9-17(10-8-14)27-20-19(22(29)26(2)23(27)30)11-15(13-24-20)21(28)25-16-5-4-6-18(12-16)31-3/h4-13H,1-3H3,(H,25,28).
What are the key properties of N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide?
N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 416.44 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 53157132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).