3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine

C10H11BrN2S — CID 3388975

IUPAC3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine
SMILESCCSCc1nc2ccccn2c1Br
InChIInChI=1S/C10H11BrN2S/c1-2-14-7-8-10(11)13-6-4-3-5-9(13)12-8/h3-6H,2,7H2,1H3
InChIKeyVAHIPWCCDUJWGV-UHFFFAOYSA-N
MW271.18 g/mol
LogP3.35
Rot. Bonds3

About 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine

3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine (PubChem CID 3388975) has the molecular formula C10H11BrN2S and a molecular weight of 271.18 g/mol. Its IUPAC name is 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine
PubChem CID3388975
Molecular FormulaC10H11BrN2S
Molecular Weight271.18 g/mol
Exact Mass269.98
IUPAC Name3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine
SMILESCCSCc1nc2ccccn2c1Br
InChIInChI=1S/C10H11BrN2S/c1-2-14-7-8-10(11)13-6-4-3-5-9(13)12-8/h3-6H,2,7H2,1H3
InChIKeyVAHIPWCCDUJWGV-UHFFFAOYSA-N
XLogP3.35
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.18
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine 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

3-Bromoimidazo[1,2-a]pyridine
CID 327951
6-Bromo-8-methylimidazo(1,2-a)pyridine
CID 5260647
2-[(4,6-Dimethylpyrimidin-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
CID 914229
2-(5-Bromo-2-thienyl)imidazo[1,2-a]pyridine
CID 711734
2-Methylimidazo[1,2-a]pyridin-3-amine
CID 15533833
3-Methyl-3H-imidazo[4,5-b]pyridine
CID 12299351
6-Bromo-3-methylimidazo(1,2-a)pyridine
CID 23537418
2-p-Tolylsulfanylmethyl-imidazo[1,2-a]pyridine
CID 914413
6-(2-methyl-3-imidazo[1,2-a]pyridinyl)-1H-pyrimidine-2-thione
CID 2745456
2-Phenyl-6-propylsulfanyl-imidazo[1,2-a]pyridine
CID 12004643
3-Cyanoimidazo(1,2-a)pyridine
CID 80330
Imidazo(1,2-a)pyridine-3-acetonitrile, 2-methyl-
CID 89050

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine (CID 3388975) is 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine is CCSCc1nc2ccccn2c1Br.
What is the InChIKey of 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is VAHIPWCCDUJWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2S/c1-2-14-7-8-10(11)13-6-4-3-5-9(13)12-8/h3-6H,2,7H2,1H3.
What are the key properties of 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine?
3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 271.18 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(ethylsulfanylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 3388975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).