N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide

C22H21N3O3 — CID 7598720

IUPACN-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCc1ccc(C)c(Cn2cccc(C(=O)Nc3ccc(C(N)=O)cc3)c2=O)c1
InChIInChI=1S/C22H21N3O3/c1-14-5-6-15(2)17(12-14)13-25-11-3-4-19(22(25)28)21(27)24-18-9-7-16(8-10-18)20(23)26/h3-12H,13H2,1-2H3,(H2,23,26)(H,24,27)
InChIKeyMONFSARJXCKUTR-UHFFFAOYSA-N
MW375.43 g/mol
LogP2.86
Rot. Bonds5

About N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide

N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 7598720) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide
PubChem CID7598720
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC NameN-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCc1ccc(C)c(Cn2cccc(C(=O)Nc3ccc(C(N)=O)cc3)c2=O)c1
InChIInChI=1S/C22H21N3O3/c1-14-5-6-15(2)17(12-14)13-25-11-3-4-19(22(25)28)21(27)24-18-9-7-16(8-10-18)20(23)26/h3-12H,13H2,1-2H3,(H2,23,26)(H,24,27)
InChIKeyMONFSARJXCKUTR-UHFFFAOYSA-N
XLogP2.86
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[[1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carbonyl]amino]benzoate
CID 7598620
1-[(2,5-dimethylphenyl)methyl]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
CID 7598626
1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide
CID 7598610
N-(4-butylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 8670906
N-(2,5-dimethylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7598638
N-(4-carbamoylphenyl)-1-[(2-fluorophenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599031
1-[(2,5-dimethylphenyl)methyl]-N-(6-methyl-2-pyridinyl)-2-oxopyridine-3-carboxamide
CID 7598678
N-(2,5-dimethylphenyl)-1-[(2-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7597915
1-[(2,5-dimethylphenyl)methyl]-N-(2-methyl-5-nitrophenyl)-2-oxopyridine-3-carboxamide
CID 7598660
1-[(2-methylphenyl)methyl]-2-oxo-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
CID 7597899
N-(1,3-benzothiazol-2-yl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7598690
N-(3-fluoro-4-methylphenyl)-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7422797

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide (CID 7598720) is N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide is Cc1ccc(C)c(Cn2cccc(C(=O)Nc3ccc(C(N)=O)cc3)c2=O)c1.
What is the InChIKey of N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide?
The InChIKey is MONFSARJXCKUTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-14-5-6-15(2)17(12-14)13-25-11-3-4-19(22(25)28)21(27)24-18-9-7-16(8-10-18)20(23)26/h3-12H,13H2,1-2H3,(H2,23,26)(H,24,27).
What are the key properties of N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide?
N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-1-[(2,5-dimethylphenyl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 7598720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).