2-(2-bromophenyl)-1-methylindole

C15H12BrN — CID 127263547

IUPAC2-(2-bromophenyl)-1-methylindole
SMILESCn1c(-c2ccccc2Br)cc2ccccc21
InChIInChI=1S/C15H12BrN/c1-17-14-9-5-2-6-11(14)10-15(17)12-7-3-4-8-13(12)16/h2-10H,1H3
InChIKeyGCWYEMJIAFOYCL-UHFFFAOYSA-N
MW286.17 g/mol
LogP4.61
Rot. Bonds1

About 2-(2-bromophenyl)-1-methylindole

2-(2-bromophenyl)-1-methylindole (PubChem CID 127263547) has the molecular formula C15H12BrN and a molecular weight of 286.17 g/mol. Its IUPAC name is 2-(2-bromophenyl)-1-methylindole.

Molecular Properties

Compound Name2-(2-bromophenyl)-1-methylindole
PubChem CID127263547
Molecular FormulaC15H12BrN
Molecular Weight286.17 g/mol
Exact Mass285.02
IUPAC Name2-(2-bromophenyl)-1-methylindole
SMILESCn1c(-c2ccccc2Br)cc2ccccc21
InChIInChI=1S/C15H12BrN/c1-17-14-9-5-2-6-11(14)10-15(17)12-7-3-4-8-13(12)16/h2-10H,1H3
InChIKeyGCWYEMJIAFOYCL-UHFFFAOYSA-N
XLogP4.61
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromophenyl)-1-ethylindole
CID 141407041
9-methyl-4-(1-methylindol-2-yl)carbazole
CID 13159227
benzene;1-methyl-2-phenylindole
CID 158316839
3-(1-methylindol-2-yl)thiophene-2-carbaldehyde
CID 82387318
3-[2-(2-bromophenyl)indol-1-yl]-5-methylcyclohex-2-en-1-one
CID 164671340
5-(1-methylindol-2-yl)pyridin-3-amine
CID 58215579
CID 175336040
CID 175336040
3-(2-bromoanilino)-1-methylquinolin-2-one
CID 24906050
1-methyl-2-(4-methylcyclohexa-1,3-dien-1-yl)indole
CID 173189823
2-(bromomethyl)-1-methylindole
CID 58970525
1-methyl-2-[4-[2-(4-phenylphenyl)ethenyl]phenyl]indole
CID 54426716
5-(2-bromophenyl)-2-chloro-1-methylimidazole
CID 117259928

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-1-methylindole?
The IUPAC name of 2-(2-bromophenyl)-1-methylindole (CID 127263547) is 2-(2-bromophenyl)-1-methylindole.
What is the SMILES notation for 2-(2-bromophenyl)-1-methylindole?
The canonical SMILES for 2-(2-bromophenyl)-1-methylindole is Cn1c(-c2ccccc2Br)cc2ccccc21.
What is the InChIKey of 2-(2-bromophenyl)-1-methylindole?
The InChIKey is GCWYEMJIAFOYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN/c1-17-14-9-5-2-6-11(14)10-15(17)12-7-3-4-8-13(12)16/h2-10H,1H3.
What are the key properties of 2-(2-bromophenyl)-1-methylindole?
2-(2-bromophenyl)-1-methylindole has a molecular weight of 286.17 g/mol, XLogP of 4.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-1-methylindole is sourced from PubChem (CID 127263547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).