5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide

C12H7BrCl2N2O — CID 731484

IUPAC5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cncc(Br)c1
InChIInChI=1S/C12H7BrCl2N2O/c13-8-1-7(5-16-6-8)12(18)17-11-3-9(14)2-10(15)4-11/h1-6H,(H,17,18)
InChIKeyOLCBTPLTHVCQDO-UHFFFAOYSA-N
MW346.01 g/mol
LogP4.40
Rot. Bonds2

About 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide

5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide (PubChem CID 731484) has the molecular formula C12H7BrCl2N2O and a molecular weight of 346.01 g/mol. Its IUPAC name is 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
PubChem CID731484
Molecular FormulaC12H7BrCl2N2O
Molecular Weight346.01 g/mol
Exact Mass343.91
IUPAC Name5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cncc(Br)c1
InChIInChI=1S/C12H7BrCl2N2O/c13-8-1-7(5-16-6-8)12(18)17-11-3-9(14)2-10(15)4-11/h1-6H,(H,17,18)
InChIKeyOLCBTPLTHVCQDO-UHFFFAOYSA-N
XLogP4.40
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.01
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dichlorophenyl)-5-methylpyridine-3-carboxamide
CID 143700451
5-bromo-N-(4-bromo-3,5-dimethylphenyl)pyridine-3-carboxamide
CID 107574886
5-bromo-N-[4-(carbamoylamino)phenyl]pyridine-3-carboxamide
CID 33152161
5-bromo-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 1267701
5-bromo-N-(4-chloro-2-fluorophenyl)pyridine-3-carboxamide
CID 7961320
5-bromo-N-[4-chloro-3-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 60865148
5-bromo-N-(2,6-dichloro-4-fluorophenyl)pyridine-3-carboxamide
CID 82889340
5-bromo-N-[4-(bromomethyl)phenyl]pyridine-3-carboxamide
CID 113274680
3-[(5-bromopyridine-3-carbonyl)amino]-4-chlorobenzoic acid
CID 28675243
5-(cyclopentylamino)-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
CID 109226240
N-(3,5-dichlorophenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109244351
N-(3,5-dichlorophenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242174

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide (CID 731484) is 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1cncc(Br)c1.
What is the InChIKey of 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide?
The InChIKey is OLCBTPLTHVCQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrCl2N2O/c13-8-1-7(5-16-6-8)12(18)17-11-3-9(14)2-10(15)4-11/h1-6H,(H,17,18).
What are the key properties of 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide?
5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide has a molecular weight of 346.01 g/mol, XLogP of 4.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 731484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).