[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol

C10H16N2OS — CID 65140344

IUPAC[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(CSC2CCCC2)[nH]1
InChIInChI=1S/C10H16N2OS/c13-6-8-5-11-10(12-8)7-14-9-3-1-2-4-9/h5,9,13H,1-4,6-7H2,(H,11,12)
InChIKeyQUPHXSDXKQPREU-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.08
Rot. Bonds4

About [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol

[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol (PubChem CID 65140344) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol
PubChem CID65140344
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(CSC2CCCC2)[nH]1
InChIInChI=1S/C10H16N2OS/c13-6-8-5-11-10(12-8)7-14-9-3-1-2-4-9/h5,9,13H,1-4,6-7H2,(H,11,12)
InChIKeyQUPHXSDXKQPREU-UHFFFAOYSA-N
XLogP2.08
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol (CID 65140344) is [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol is OCc1cnc(CSC2CCCC2)[nH]1.
What is the InChIKey of [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol?
The InChIKey is QUPHXSDXKQPREU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c13-6-8-5-11-10(12-8)7-14-9-3-1-2-4-9/h5,9,13H,1-4,6-7H2,(H,11,12).
What are the key properties of [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol?
[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol has a molecular weight of 212.32 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 65140344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).