2-(4-bromophenyl)-7-methyl-1H-indole

C15H12BrN — CID 86031866

IUPAC2-(4-bromophenyl)-7-methyl-1H-indole
SMILESCc1cccc2cc(-c3ccc(Br)cc3)[nH]c12
InChIInChI=1S/C15H12BrN/c1-10-3-2-4-12-9-14(17-15(10)12)11-5-7-13(16)8-6-11/h2-9,17H,1H3
InChIKeyYPZPKKNXNYTPML-UHFFFAOYSA-N
MW286.17 g/mol
LogP4.91
Rot. Bonds1

About 2-(4-bromophenyl)-7-methyl-1H-indole

2-(4-bromophenyl)-7-methyl-1H-indole (PubChem CID 86031866) has the molecular formula C15H12BrN and a molecular weight of 286.17 g/mol. Its IUPAC name is 2-(4-bromophenyl)-7-methyl-1H-indole.

Molecular Properties

Compound Name2-(4-bromophenyl)-7-methyl-1H-indole
PubChem CID86031866
Molecular FormulaC15H12BrN
Molecular Weight286.17 g/mol
Exact Mass285.02
IUPAC Name2-(4-bromophenyl)-7-methyl-1H-indole
SMILESCc1cccc2cc(-c3ccc(Br)cc3)[nH]c12
InChIInChI=1S/C15H12BrN/c1-10-3-2-4-12-9-14(17-15(10)12)11-5-7-13(16)8-6-11/h2-9,17H,1H3
InChIKeyYPZPKKNXNYTPML-UHFFFAOYSA-N
XLogP4.91
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

7-fluoro-2-(4-methylphenyl)-1H-indole
CID 131886972
5-(4-bromophenyl)-2,3-dimethyl-1H-pyrrole
CID 141116599
5,7-dimethyl-2-(4-methylphenyl)-1H-indole
CID 131886944
7-chloro-2-(4-chlorophenyl)-1H-indole
CID 14045525
7-bromo-2-(2,5-dimethylphenyl)-1H-indole
CID 131886878
trimethyl-(7-methyl-1H-indol-2-yl)silane
CID 15121722
2-(4-fluorophenyl)-6,7-dimethyl-1H-indole
CID 131886920
4-(7-fluoro-1H-indol-2-yl)aniline
CID 71602424
7-bromo-2-(3-chlorophenyl)-1H-indole
CID 131886846
2-(7-methyl-1H-indol-2-yl)furan-3-carboxylic acid
CID 82387630
1-methyl-5-(7-methyl-1H-indol-2-yl)pyrazole-3-carboxylic acid
CID 136985722
2-(7-methyl-1H-indol-2-yl)pyridine-4-carboxylic acid
CID 115113789

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-7-methyl-1H-indole?
The IUPAC name of 2-(4-bromophenyl)-7-methyl-1H-indole (CID 86031866) is 2-(4-bromophenyl)-7-methyl-1H-indole.
What is the SMILES notation for 2-(4-bromophenyl)-7-methyl-1H-indole?
The canonical SMILES for 2-(4-bromophenyl)-7-methyl-1H-indole is Cc1cccc2cc(-c3ccc(Br)cc3)[nH]c12.
What is the InChIKey of 2-(4-bromophenyl)-7-methyl-1H-indole?
The InChIKey is YPZPKKNXNYTPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN/c1-10-3-2-4-12-9-14(17-15(10)12)11-5-7-13(16)8-6-11/h2-9,17H,1H3.
What are the key properties of 2-(4-bromophenyl)-7-methyl-1H-indole?
2-(4-bromophenyl)-7-methyl-1H-indole has a molecular weight of 286.17 g/mol, XLogP of 4.91, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-7-methyl-1H-indole is sourced from PubChem (CID 86031866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).