N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide

C18H13BrN2O — CID 99705381

IUPACN-(2-bromophenyl)-5-phenylpyridine-3-carboxamide
SMILESO=C(Nc1ccccc1Br)c1cncc(-c2ccccc2)c1
InChIInChI=1S/C18H13BrN2O/c19-16-8-4-5-9-17(16)21-18(22)15-10-14(11-20-12-15)13-6-2-1-3-7-13/h1-12H,(H,21,22)
InChIKeyZOHOEPQEWUOLQL-UHFFFAOYSA-N
MW353.22 g/mol
LogP4.76
Rot. Bonds3

About N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide

N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide (PubChem CID 99705381) has the molecular formula C18H13BrN2O and a molecular weight of 353.22 g/mol. Its IUPAC name is N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-5-phenylpyridine-3-carboxamide
PubChem CID99705381
Molecular FormulaC18H13BrN2O
Molecular Weight353.22 g/mol
Exact Mass352.02
IUPAC NameN-(2-bromophenyl)-5-phenylpyridine-3-carboxamide
SMILESO=C(Nc1ccccc1Br)c1cncc(-c2ccccc2)c1
InChIInChI=1S/C18H13BrN2O/c19-16-8-4-5-9-17(16)21-18(22)15-10-14(11-20-12-15)13-6-2-1-3-7-13/h1-12H,(H,21,22)
InChIKeyZOHOEPQEWUOLQL-UHFFFAOYSA-N
XLogP4.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.22
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,5-diphenylpyridine-3-carboxamide
CID 110683714
N-[2-(difluoromethoxy)phenyl]-5-phenylpyridine-3-carboxamide
CID 174627976
N-(2-bromophenyl)-5-(diethylamino)pyridine-3-carboxamide
CID 109238971
N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223122
N-(2-bromophenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241090
N-(2-bromophenyl)pyridine-4-carboxamide
CID 882176
sodium;hydride;4-phenyl-2-[(5-pyridin-4-ylpyridine-3-carbonyl)amino]benzoic acid
CID 173036826
N-(1,5-dimethyl-2-oxo-3-pyridinyl)-5-phenylpyridine-3-carboxamide
CID 154801805
3,5-dibromo-N-(2-bromophenyl)benzamide
CID 107972328
2-[(5-bromopyridine-3-carbonyl)amino]benzoic acid
CID 805036
N-(4-methoxyphenyl)-5-phenylpyridine-3-carboxamide
CID 110683719
N-(2-bromophenyl)-5-(4-cyanoanilino)pyridine-3-carboxamide
CID 109246141

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide?
The IUPAC name of N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide (CID 99705381) is N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide?
The canonical SMILES for N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide is O=C(Nc1ccccc1Br)c1cncc(-c2ccccc2)c1.
What is the InChIKey of N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide?
The InChIKey is ZOHOEPQEWUOLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13BrN2O/c19-16-8-4-5-9-17(16)21-18(22)15-10-14(11-20-12-15)13-6-2-1-3-7-13/h1-12H,(H,21,22).
What are the key properties of N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide?
N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide has a molecular weight of 353.22 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide is sourced from PubChem (CID 99705381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).