[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol

C15H24N2OS — CID 79581411

IUPAC[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol
SMILESCCNC1(CO)CCCC1CCSc1ccccn1
InChIInChI=1S/C15H24N2OS/c1-2-17-15(12-18)9-5-6-13(15)8-11-19-14-7-3-4-10-16-14/h3-4,7,10,13,17-18H,2,5-6,8-9,11-12H2,1H3
InChIKeyCFOPPRNJZIORQJ-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.70
Rot. Bonds7

About [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol

[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol (PubChem CID 79581411) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol
PubChem CID79581411
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol
SMILESCCNC1(CO)CCCC1CCSc1ccccn1
InChIInChI=1S/C15H24N2OS/c1-2-17-15(12-18)9-5-6-13(15)8-11-19-14-7-3-4-10-16-14/h3-4,7,10,13,17-18H,2,5-6,8-9,11-12H2,1H3
InChIKeyCFOPPRNJZIORQJ-UHFFFAOYSA-N
XLogP2.70
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)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-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol?
The IUPAC name of [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol (CID 79581411) is [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol.
What is the SMILES notation for [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol?
The canonical SMILES for [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol is CCNC1(CO)CCCC1CCSc1ccccn1.
What is the InChIKey of [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol?
The InChIKey is CFOPPRNJZIORQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-2-17-15(12-18)9-5-6-13(15)8-11-19-14-7-3-4-10-16-14/h3-4,7,10,13,17-18H,2,5-6,8-9,11-12H2,1H3.
What are the key properties of [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol?
[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol has a molecular weight of 280.44 g/mol, XLogP of 2.70, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol is sourced from PubChem (CID 79581411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).