6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile

C8H3BrIN3 — CID 167037554

IUPAC6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile
SMILESN#Cc1c(Br)cn2ccnc2c1I
InChIInChI=1S/C8H3BrIN3/c9-6-4-13-2-1-12-8(13)7(10)5(6)3-11/h1-2,4H
InChIKeyTZKDHJFAADKRJT-UHFFFAOYSA-N
MW347.94 g/mol
LogP2.57
Rot. Bonds

About 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile

6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile (PubChem CID 167037554) has the molecular formula C8H3BrIN3 and a molecular weight of 347.94 g/mol. Its IUPAC name is 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile.

Molecular Properties

Compound Name6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile
PubChem CID167037554
Molecular FormulaC8H3BrIN3
Molecular Weight347.94 g/mol
Exact Mass346.86
IUPAC Name6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile
SMILESN#Cc1c(Br)cn2ccnc2c1I
InChIInChI=1S/C8H3BrIN3/c9-6-4-13-2-1-12-8(13)7(10)5(6)3-11/h1-2,4H
InChIKeyTZKDHJFAADKRJT-UHFFFAOYSA-N
XLogP2.57
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.94
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile 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

4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxybenzonitrile
CID 79955212
8-bromo-6-chloroimidazo[1,2-a]pyrazine
CID 12841570
8-iodoimidazo[1,2-a]pyridin-6-amine
CID 124518952
8-iodo-6-methylimidazo[1,2-a]pyridine
CID 71299172
6-bromo-8-ethoxyimidazo[1,2-a]pyridine
CID 58208009
2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-4-bromobenzonitrile
CID 107801734
3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-methylamino]benzonitrile
CID 79947007
5-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-2-fluorobenzonitrile
CID 79947258
4-bromo-3-cyano-2-iodobenzenesulfonyl chloride
CID 118850809
5,7-dimethylimidazo[1,2-c]pyrimidine-8-carbonitrile
CID 177024639
6-iodo-N-methylimidazo[1,2-a]pyrazin-8-amine
CID 146178980
(6-bromoimidazo[1,2-a]pyridin-8-yl)hydrazine
CID 71156505

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile?
The IUPAC name of 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile (CID 167037554) is 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile.
What is the SMILES notation for 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile?
The canonical SMILES for 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile is N#Cc1c(Br)cn2ccnc2c1I.
What is the InChIKey of 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile?
The InChIKey is TZKDHJFAADKRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3BrIN3/c9-6-4-13-2-1-12-8(13)7(10)5(6)3-11/h1-2,4H.
What are the key properties of 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile?
6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile has a molecular weight of 347.94 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-iodoimidazo[1,2-a]pyridine-7-carbonitrile is sourced from PubChem (CID 167037554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).