7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine

C11H8ClN3S — CID 22250072

IUPAC7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine
SMILESCn1cncc1-c1cc2nccc(Cl)c2s1
InChIInChI=1S/C11H8ClN3S/c1-15-6-13-5-9(15)10-4-8-11(16-10)7(12)2-3-14-8/h2-6H,1H3
InChIKeyWWUMCGZQACAQEO-UHFFFAOYSA-N
MW249.73 g/mol
LogP3.35
Rot. Bonds1

About 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine

7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine (PubChem CID 22250072) has the molecular formula C11H8ClN3S and a molecular weight of 249.73 g/mol. Its IUPAC name is 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine.

Molecular Properties

Compound Name7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine
PubChem CID22250072
Molecular FormulaC11H8ClN3S
Molecular Weight249.73 g/mol
Exact Mass249.01
IUPAC Name7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine
SMILESCn1cncc1-c1cc2nccc(Cl)c2s1
InChIInChI=1S/C11H8ClN3S/c1-15-6-13-5-9(15)10-4-8-11(16-10)7(12)2-3-14-8/h2-6H,1H3
InChIKeyWWUMCGZQACAQEO-UHFFFAOYSA-N
XLogP3.35
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.73
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-Bromothiophen-2-yl)-6-chloroimidazo[1,2-a]pyridine
CID 3850729
5-[(5-Chloro-2-thienyl)methyl]-2-phenyl-5h-imidazo[4,5-c]pyridine
CID 10064916
N,N-dimethyl-4-pyrazin-2-ylthieno[3,2-d]pyrimidin-2-amine
CID 44449567
N,N-dimethyl-4-pyridin-2-ylthieno[3,2-d]pyrimidin-2-amine
CID 44449568
N,N-dimethyl-4-(1-methylimidazol-2-yl)thieno[3,2-d]pyrimidin-2-amine
CID 44449599
2-(5-Chloro-thiophen-2-yl)-5-imidazol-1-ylmethyl-pyridine
CID 67511528
4-(3-chloro-2-thienyl)-2-(1H-pyrrol-1-yl)pyrimidine
CID 4255524
6-chloro-N-(4-chlorophenyl)-2-(thiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 7066882
5-Chloro-2-(3-imidazol-1-ylpropylsulfanyl)-1,3-benzothiazole
CID 118733129
5-Chloro-2-(4-imidazol-1-ylbutylsulfanyl)-1,3-benzothiazole
CID 118733130
5-Chloro-2-(5-imidazol-1-ylpentylsulfanyl)-1,3-benzothiazole
CID 118733131
4-(5-chloro-2-thienyl)-2-(1H-pyrrol-1-yl)pyrimidine
CID 4312367

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine?
The IUPAC name of 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine (CID 22250072) is 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine.
What is the SMILES notation for 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine?
The canonical SMILES for 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine is Cn1cncc1-c1cc2nccc(Cl)c2s1.
What is the InChIKey of 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine?
The InChIKey is WWUMCGZQACAQEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN3S/c1-15-6-13-5-9(15)10-4-8-11(16-10)7(12)2-3-14-8/h2-6H,1H3.
What are the key properties of 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine?
7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine has a molecular weight of 249.73 g/mol, XLogP of 3.35, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(3-methylimidazol-4-yl)thieno[3,2-b]pyridine is sourced from PubChem (CID 22250072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).