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

C15H10BrFN2O — CID 60865687

IUPAC2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide
SMILESO=C(Nc1ccc2[nH]ccc2c1)c1cc(F)ccc1Br
InChIInChI=1S/C15H10BrFN2O/c16-13-3-1-10(17)8-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-8,18H,(H,19,20)
InChIKeyVUQBOCHLHFENPF-UHFFFAOYSA-N
MW333.16 g/mol
LogP4.32
Rot. Bonds2

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

2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide (PubChem CID 60865687) has the molecular formula C15H10BrFN2O and a molecular weight of 333.16 g/mol. Its IUPAC name is 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide.

Molecular Properties

Compound Name2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide
PubChem CID60865687
Molecular FormulaC15H10BrFN2O
Molecular Weight333.16 g/mol
Exact Mass332.00
IUPAC Name2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide
SMILESO=C(Nc1ccc2[nH]ccc2c1)c1cc(F)ccc1Br
InChIInChI=1S/C15H10BrFN2O/c16-13-3-1-10(17)8-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-8,18H,(H,19,20)
InChIKeyVUQBOCHLHFENPF-UHFFFAOYSA-N
XLogP4.32
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.16
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-4-chloro-N-(1H-indol-5-yl)benzamide
CID 103763682
2-bromo-5-fluoro-N-(2-methyl-3H-benzimidazol-5-yl)benzamide
CID 60707578
5-bromo-N-(1H-indol-5-yl)-2-methylbenzamide
CID 65309477
N-[4-fluoro-2-(1H-indol-5-ylcarbamoyl)phenyl]-4-methylpiperazine-1-carboxamide
CID 52898372
2-bromo-5-fluoro-N-pyridin-4-ylbenzamide
CID 24689645
N-(3-amino-4-fluorophenyl)-2-bromo-5-fluorobenzamide
CID 16777839
2-bromo-N-(4-chloro-3-hydroxyphenyl)-5-fluorobenzamide
CID 64789249
4-[(2-bromo-5-fluorobenzoyl)amino]benzenesulfonyl chloride
CID 43102869
2-bromo-5-fluoro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 60731828
2,4-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571914
N-(3-amino-4-chlorophenyl)-2-bromo-5-fluorobenzamide
CID 16777113
N-[1-(4-fluorophenyl)ethenyl]-1H-indol-5-amine
CID 142618850

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide?
The IUPAC name of 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide (CID 60865687) is 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide.
What is the SMILES notation for 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide?
The canonical SMILES for 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide is O=C(Nc1ccc2[nH]ccc2c1)c1cc(F)ccc1Br.
What is the InChIKey of 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide?
The InChIKey is VUQBOCHLHFENPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrFN2O/c16-13-3-1-10(17)8-12(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-5-fluoro-N-(1H-indol-5-yl)benzamide?
2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide has a molecular weight of 333.16 g/mol, XLogP of 4.32, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-fluoro-N-(1H-indol-5-yl)benzamide is sourced from PubChem (CID 60865687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).