2-bromo-3-(2-bromophenyl)quinoline

C15H9Br2N — CID 170972432

IUPAC2-bromo-3-(2-bromophenyl)quinoline
SMILESBrc1ccccc1-c1cc2ccccc2nc1Br
InChIInChI=1S/C15H9Br2N/c16-13-7-3-2-6-11(13)12-9-10-5-1-4-8-14(10)18-15(12)17/h1-9H
InChIKeyQRFUPBNHOOQTPG-UHFFFAOYSA-N
MW363.05 g/mol
LogP5.43
Rot. Bonds1

About 2-bromo-3-(2-bromophenyl)quinoline

2-bromo-3-(2-bromophenyl)quinoline (PubChem CID 170972432) has the molecular formula C15H9Br2N and a molecular weight of 363.05 g/mol. Its IUPAC name is 2-bromo-3-(2-bromophenyl)quinoline.

Molecular Properties

Compound Name2-bromo-3-(2-bromophenyl)quinoline
PubChem CID170972432
Molecular FormulaC15H9Br2N
Molecular Weight363.05 g/mol
Exact Mass360.91
IUPAC Name2-bromo-3-(2-bromophenyl)quinoline
SMILESBrc1ccccc1-c1cc2ccccc2nc1Br
InChIInChI=1S/C15H9Br2N/c16-13-7-3-2-6-11(13)12-9-10-5-1-4-8-14(10)18-15(12)17/h1-9H
InChIKeyQRFUPBNHOOQTPG-UHFFFAOYSA-N
XLogP5.43
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.05
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-bromo-3-(2-bromophenyl)quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-3-(2-chloroethyl)quinoline
CID 116985321
acridine
CID 21226281
2-bromo-3-(1-bromoethyl)quinoline
CID 22745004
acridine;methane
CID 21324126
acridine;sulfane
CID 159134653
acridine;iron
CID 158030240
acridine;dihydrate
CID 172843020
acridine;argon
CID 157415582
1-(2-bromoquinolin-3-yl)cyclopropan-1-amine
CID 116985405
acridine;ethane
CID 123684759
1-(2-bromonaphthalen-1-yl)acridine
CID 175119023
2-[4-(2-bromophenyl)phenyl]-3-(4-naphthalen-2-ylphenyl)quinoxaline
CID 175102190

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-(2-bromophenyl)quinoline?
The IUPAC name of 2-bromo-3-(2-bromophenyl)quinoline (CID 170972432) is 2-bromo-3-(2-bromophenyl)quinoline.
What is the SMILES notation for 2-bromo-3-(2-bromophenyl)quinoline?
The canonical SMILES for 2-bromo-3-(2-bromophenyl)quinoline is Brc1ccccc1-c1cc2ccccc2nc1Br.
What is the InChIKey of 2-bromo-3-(2-bromophenyl)quinoline?
The InChIKey is QRFUPBNHOOQTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Br2N/c16-13-7-3-2-6-11(13)12-9-10-5-1-4-8-14(10)18-15(12)17/h1-9H.
What are the key properties of 2-bromo-3-(2-bromophenyl)quinoline?
2-bromo-3-(2-bromophenyl)quinoline has a molecular weight of 363.05 g/mol, XLogP of 5.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-(2-bromophenyl)quinoline is sourced from PubChem (CID 170972432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).