2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine

C12H11N3S — CID 156838859

IUPAC2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine
SMILESCc1scc(-c2nc3ccncc3[nH]2)c1C
InChIInChI=1S/C12H11N3S/c1-7-8(2)16-6-9(7)12-14-10-3-4-13-5-11(10)15-12/h3-6H,1-2H3,(H,14,15)
InChIKeyFYRNTKLXDCRQIC-UHFFFAOYSA-N
MW229.31 g/mol
LogP3.30
Rot. Bonds1

About 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine

2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine (PubChem CID 156838859) has the molecular formula C12H11N3S and a molecular weight of 229.31 g/mol. Its IUPAC name is 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine
PubChem CID156838859
Molecular FormulaC12H11N3S
Molecular Weight229.31 g/mol
Exact Mass229.07
IUPAC Name2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine
SMILESCc1scc(-c2nc3ccncc3[nH]2)c1C
InChIInChI=1S/C12H11N3S/c1-7-8(2)16-6-9(7)12-14-10-3-4-13-5-11(10)15-12/h3-6H,1-2H3,(H,14,15)
InChIKeyFYRNTKLXDCRQIC-UHFFFAOYSA-N
XLogP3.30
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.31
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine
CID 67896478
4-(3H-imidazo[4,5-c]pyridin-2-yl)-5-methylthiophen-3-ol
CID 67896665
2-(3-chloro-4-methylthiophen-2-yl)-3H-imidazo[4,5-c]pyridine
CID 103402838
2-(2-fluoro-3-methylphenyl)-3H-imidazo[4,5-c]pyridine
CID 81477423
2-(2-methyl-4-prop-2-enoxythiophen-3-yl)-3H-imidazo[4,5-c]pyridine
CID 67896732
4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,3-thiazol-2-amine
CID 63268954
2-[2-(1-phenylethoxy)phenyl]-3H-imidazo[4,5-c]pyridine
CID 19864779
2-(5-methylpyrazin-2-yl)-3H-imidazo[4,5-c]pyridine
CID 63269092
3-(3H-imidazo[4,5-c]pyridin-2-yl)benzene-1,2-diol
CID 136928276
2-(2-methoxy-3-pyridinyl)-3H-imidazo[4,5-c]pyridine
CID 63268642
3-(3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyridin-4-one
CID 136812530
2-[2-(fluoromethyl)phenyl]-3H-imidazo[4,5-c]pyridine
CID 143605442

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine (CID 156838859) is 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine is Cc1scc(-c2nc3ccncc3[nH]2)c1C.
What is the InChIKey of 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine?
The InChIKey is FYRNTKLXDCRQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3S/c1-7-8(2)16-6-9(7)12-14-10-3-4-13-5-11(10)15-12/h3-6H,1-2H3,(H,14,15).
What are the key properties of 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine?
2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine has a molecular weight of 229.31 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 156838859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).