[1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol

C12H23NOS — CID 79580960

IUPAC[1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol
SMILESCSCCC1CCCC1(CO)NC1CC1
InChIInChI=1S/C12H23NOS/c1-15-8-6-10-3-2-7-12(10,9-14)13-11-4-5-11/h10-11,13-14H,2-9H2,1H3
InChIKeyCNLPELQNFMBBSE-UHFFFAOYSA-N
MW229.39 g/mol
LogP2.02
Rot. Bonds6

About [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol

[1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol (PubChem CID 79580960) has the molecular formula C12H23NOS and a molecular weight of 229.39 g/mol. Its IUPAC name is [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol
PubChem CID79580960
Molecular FormulaC12H23NOS
Molecular Weight229.39 g/mol
Exact Mass229.15
IUPAC Name[1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol
SMILESCSCCC1CCCC1(CO)NC1CC1
InChIInChI=1S/C12H23NOS/c1-15-8-6-10-3-2-7-12(10,9-14)13-11-4-5-11/h10-11,13-14H,2-9H2,1H3
InChIKeyCNLPELQNFMBBSE-UHFFFAOYSA-N
XLogP2.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.39
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]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 [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol (CID 79580960) is [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol is CSCCC1CCCC1(CO)NC1CC1.
What is the InChIKey of [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol?
The InChIKey is CNLPELQNFMBBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NOS/c1-15-8-6-10-3-2-7-12(10,9-14)13-11-4-5-11/h10-11,13-14H,2-9H2,1H3.
What are the key properties of [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol?
[1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol has a molecular weight of 229.39 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-2-(2-methylsulfanylethyl)cyclopentyl]methanol is sourced from PubChem (CID 79580960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).