2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole

C8H10N2S — CID 14964720

IUPAC2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole
SMILESCc1ccsc1C1=NCCN1
InChIInChI=1S/C8H10N2S/c1-6-2-5-11-7(6)8-9-3-4-10-8/h2,5H,3-4H2,1H3,(H,9,10)
InChIKeyMCGKHSFUMBTMDI-UHFFFAOYSA-N
MW166.25 g/mol
LogP1.41
Rot. Bonds1

About 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole

2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole (PubChem CID 14964720) has the molecular formula C8H10N2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole
PubChem CID14964720
Molecular FormulaC8H10N2S
Molecular Weight166.25 g/mol
Exact Mass166.06
IUPAC Name2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole
SMILESCc1ccsc1C1=NCCN1
InChIInChI=1S/C8H10N2S/c1-6-2-5-11-7(6)8-9-3-4-10-8/h2,5H,3-4H2,1H3,(H,9,10)
InChIKeyMCGKHSFUMBTMDI-UHFFFAOYSA-N
XLogP1.41
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole (CID 14964720) is 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole is Cc1ccsc1C1=NCCN1.
What is the InChIKey of 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole?
The InChIKey is MCGKHSFUMBTMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2S/c1-6-2-5-11-7(6)8-9-3-4-10-8/h2,5H,3-4H2,1H3,(H,9,10).
What are the key properties of 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole?
2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole has a molecular weight of 166.25 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylthiophen-2-yl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 14964720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).