2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide

C15H10BrClN2O — CID 103763682

IUPAC2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide
SMILESO=C(Nc1ccc2[nH]ccc2c1)c1ccc(Cl)cc1Br
InChIInChI=1S/C15H10BrClN2O/c16-13-8-10(17)1-3-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-8,18H,(H,19,20)
InChIKeyYGJIHZYADLZLIZ-UHFFFAOYSA-N
MW349.62 g/mol
LogP4.84
Rot. Bonds2

About 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide

2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide (PubChem CID 103763682) has the molecular formula C15H10BrClN2O and a molecular weight of 349.62 g/mol. Its IUPAC name is 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide.

Molecular Properties

Compound Name2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide
PubChem CID103763682
Molecular FormulaC15H10BrClN2O
Molecular Weight349.62 g/mol
Exact Mass347.97
IUPAC Name2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide
SMILESO=C(Nc1ccc2[nH]ccc2c1)c1ccc(Cl)cc1Br
InChIInChI=1S/C15H10BrClN2O/c16-13-8-10(17)1-3-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-8,18H,(H,19,20)
InChIKeyYGJIHZYADLZLIZ-UHFFFAOYSA-N
XLogP4.84
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.62
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571914
2-amino-4-chloro-N-(1H-indol-5-yl)benzamide
CID 63110093
3,5-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571909
5-bromo-N-(1H-indol-5-yl)-2-methylbenzamide
CID 65309477
2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide
CID 60865687
2-bromo-4-chloro-N-(4-methylphenyl)benzamide
CID 103763138
5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide
CID 103763706
2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide
CID 103763591
6-chloro-N-(1H-indol-5-yl)pyrazine-2-carboxamide
CID 103186986
2-bromo-4-chloro-N-(4-chloro-3-nitrophenyl)benzamide
CID 103763477
2-bromo-N-(4-carbamoylphenyl)-4-chlorobenzamide
CID 103763181
N-(4-acetylphenyl)-2-bromo-4-chlorobenzamide
CID 103763178

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide?
The IUPAC name of 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide (CID 103763682) is 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide.
What is the SMILES notation for 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide?
The canonical SMILES for 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide is O=C(Nc1ccc2[nH]ccc2c1)c1ccc(Cl)cc1Br.
What is the InChIKey of 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide?
The InChIKey is YGJIHZYADLZLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClN2O/c16-13-8-10(17)1-3-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-8,18H,(H,19,20).
What are the key properties of 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide?
2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide has a molecular weight of 349.62 g/mol, XLogP of 4.84, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide is sourced from PubChem (CID 103763682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).