1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide

C19H15BrN2O2 — CID 7422670

IUPAC1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1cccn(Cc2ccccc2)c1=O
InChIInChI=1S/C19H15BrN2O2/c20-15-8-4-9-16(12-15)21-18(23)17-10-5-11-22(19(17)24)13-14-6-2-1-3-7-14/h1-12H,13H2,(H,21,23)
InChIKeyCHYIBWUQNZZIII-UHFFFAOYSA-N
MW383.25 g/mol
LogP3.91
Rot. Bonds4

About 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide

1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide (PubChem CID 7422670) has the molecular formula C19H15BrN2O2 and a molecular weight of 383.25 g/mol. Its IUPAC name is 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide
PubChem CID7422670
Molecular FormulaC19H15BrN2O2
Molecular Weight383.25 g/mol
Exact Mass382.03
IUPAC Name1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1cccn(Cc2ccccc2)c1=O
InChIInChI=1S/C19H15BrN2O2/c20-15-8-4-9-16(12-15)21-18(23)17-10-5-11-22(19(17)24)13-14-6-2-1-3-7-14/h1-12H,13H2,(H,21,23)
InChIKeyCHYIBWUQNZZIII-UHFFFAOYSA-N
XLogP3.91
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.25
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7598727
N-(3-acetylphenyl)-1-benzyl-2-oxopyridine-3-carboxamide
CID 7422689
1-[(4-chlorophenyl)methyl]-N-(3-methylphenyl)-2-oxopyridine-3-carboxamide
CID 7598003
1-[(4-fluorophenyl)methyl]-N-(3-methylphenyl)-2-oxopyridine-3-carboxamide
CID 7597691
1-[(3-chlorophenyl)methyl]-N-(3,4-dichlorophenyl)-2-oxopyridine-3-carboxamide
CID 8670922
1-benzyl-N-(2,3-dichlorophenyl)-2-oxopyridine-3-carboxamide
CID 7422695
N-(4-acetamidophenyl)-1-[(3-chlorophenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599167
N-(3-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110382923
N-(3-methylphenyl)-1-[(3-nitrophenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599175
N-(4-bromophenyl)-2-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 26843720
N-(3-acetylphenyl)-1-[(3-nitrophenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599212
1-benzyl-N-(3-chloro-2-methylphenyl)-2-oxopyridine-3-carboxamide
CID 7422717

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide (CID 7422670) is 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide is O=C(Nc1cccc(Br)c1)c1cccn(Cc2ccccc2)c1=O.
What is the InChIKey of 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide?
The InChIKey is CHYIBWUQNZZIII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrN2O2/c20-15-8-4-9-16(12-15)21-18(23)17-10-5-11-22(19(17)24)13-14-6-2-1-3-7-14/h1-12H,13H2,(H,21,23).
What are the key properties of 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide?
1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide has a molecular weight of 383.25 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(3-bromophenyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 7422670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).