N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide

C22H21N3O3 — CID 110383049

IUPACN-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide
SMILESCCc1ccc(Cn2cc(C(=O)Nc3ccc(C(N)=O)cc3)ccc2=O)cc1
InChIInChI=1S/C22H21N3O3/c1-2-15-3-5-16(6-4-15)13-25-14-18(9-12-20(25)26)22(28)24-19-10-7-17(8-11-19)21(23)27/h3-12,14H,2,13H2,1H3,(H2,23,27)(H,24,28)
InChIKeyGPIJMENGVNJCJQ-UHFFFAOYSA-N
MW375.43 g/mol
LogP2.81
Rot. Bonds6

About N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide

N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide (PubChem CID 110383049) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide
PubChem CID110383049
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC NameN-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide
SMILESCCc1ccc(Cn2cc(C(=O)Nc3ccc(C(N)=O)cc3)ccc2=O)cc1
InChIInChI=1S/C22H21N3O3/c1-2-15-3-5-16(6-4-15)13-25-14-18(9-12-20(25)26)22(28)24-19-10-7-17(8-11-19)21(23)27/h3-12,14H,2,13H2,1H3,(H2,23,27)(H,24,28)
InChIKeyGPIJMENGVNJCJQ-UHFFFAOYSA-N
XLogP2.81
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethoxyphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 110382704
1-[(3-chlorophenyl)methyl]-N-(4-ethylphenyl)-6-oxopyridine-3-carboxamide
CID 26844080
N-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 3731074
N-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 26843818
N-(4-acetylphenyl)-1-[(4-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8671146
butyl 4-[[1-[(4-fluorophenyl)methyl]-6-oxopyridine-3-carbonyl]amino]benzoate
CID 8671148
N-(4-ethylphenyl)-1-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
CID 53040752
1-[2-(4-ethylanilino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide
CID 47505343
1-[(4-fluorophenyl)methyl]-6-oxo-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 26843824
N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 110383047
1-[(4-chlorophenyl)methyl]-6-oxo-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 5122579
N-(4-acetamidophenyl)-1-[(3-chlorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8697563

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide?
The IUPAC name of N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide (CID 110383049) is N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide is CCc1ccc(Cn2cc(C(=O)Nc3ccc(C(N)=O)cc3)ccc2=O)cc1.
What is the InChIKey of N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide?
The InChIKey is GPIJMENGVNJCJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-2-15-3-5-16(6-4-15)13-25-14-18(9-12-20(25)26)22(28)24-19-10-7-17(8-11-19)21(23)27/h3-12,14H,2,13H2,1H3,(H2,23,27)(H,24,28).
What are the key properties of N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide?
N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 2.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 110383049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).