3-bromo-N-(3-chlorophenyl)benzamide

C13H9BrClNO — CID 531997

IUPAC3-bromo-N-(3-chlorophenyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1cccc(Br)c1
InChIInChI=1S/C13H9BrClNO/c14-10-4-1-3-9(7-10)13(17)16-12-6-2-5-11(15)8-12/h1-8H,(H,16,17)
InChIKeyNJSBTVPSISSHNU-UHFFFAOYSA-N
MW310.58 g/mol
LogP4.35
Rot. Bonds2

About 3-bromo-N-(3-chlorophenyl)benzamide

3-bromo-N-(3-chlorophenyl)benzamide (PubChem CID 531997) has the molecular formula C13H9BrClNO and a molecular weight of 310.58 g/mol. Its IUPAC name is 3-bromo-N-(3-chlorophenyl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(3-chlorophenyl)benzamide
PubChem CID531997
Molecular FormulaC13H9BrClNO
Molecular Weight310.58 g/mol
Exact Mass308.96
IUPAC Name3-bromo-N-(3-chlorophenyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1cccc(Br)c1
InChIInChI=1S/C13H9BrClNO/c14-10-4-1-3-9(7-10)13(17)16-12-6-2-5-11(15)8-12/h1-8H,(H,16,17)
InChIKeyNJSBTVPSISSHNU-UHFFFAOYSA-N
XLogP4.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.58
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Benzamide, N-(3-bromophenyl)-
CID 202396
Benzamide, N-(4-chlorophenyl)-
CID 96646
N-(3-Chlorophenyl)benzamide
CID 95833
N-(2-Chlorophenyl)benzamide
CID 13918
4'-Bromo-2-chlorobenzanilide
CID 221829
3'-Chloro-M-toluanilide
CID 531963
Benzamide, 2-bromo-N-(4-bromophenyl)-
CID 603324
N-(2-chlorophenyl)-4-methylbenzamide
CID 723111
Benzamide, N-(4-bromophenyl)-
CID 101357
Benzamide, N-(3,4-dichlorophenyl)-
CID 82516
2-amino-N-(3-chlorophenyl)benzamide
CID 720859
N-(3-chlorophenyl)-3-fluorobenzamide
CID 532008

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(3-chlorophenyl)benzamide?
The IUPAC name of 3-bromo-N-(3-chlorophenyl)benzamide (CID 531997) is 3-bromo-N-(3-chlorophenyl)benzamide.
What is the SMILES notation for 3-bromo-N-(3-chlorophenyl)benzamide?
The canonical SMILES for 3-bromo-N-(3-chlorophenyl)benzamide is O=C(Nc1cccc(Cl)c1)c1cccc(Br)c1.
What is the InChIKey of 3-bromo-N-(3-chlorophenyl)benzamide?
The InChIKey is NJSBTVPSISSHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrClNO/c14-10-4-1-3-9(7-10)13(17)16-12-6-2-5-11(15)8-12/h1-8H,(H,16,17).
What are the key properties of 3-bromo-N-(3-chlorophenyl)benzamide?
3-bromo-N-(3-chlorophenyl)benzamide has a molecular weight of 310.58 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(3-chlorophenyl)benzamide is sourced from PubChem (CID 531997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).