1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol

C10H15NOS — CID 164654563

IUPAC1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)[C@@H]1CCNC1
InChIInChI=1S/C10H15NOS/c12-10(8-3-4-11-7-8)6-9-2-1-5-13-9/h1-2,5,8,10-12H,3-4,6-7H2/t8-,10?/m1/s1
InChIKeyLUSBRBYRJKGFKS-HNHGDDPOSA-N
MW197.30 g/mol
LogP1.26
Rot. Bonds3

About 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol

1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol (PubChem CID 164654563) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol
PubChem CID164654563
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)[C@@H]1CCNC1
InChIInChI=1S/C10H15NOS/c12-10(8-3-4-11-7-8)6-9-2-1-5-13-9/h1-2,5,8,10-12H,3-4,6-7H2/t8-,10?/m1/s1
InChIKeyLUSBRBYRJKGFKS-HNHGDDPOSA-N
XLogP1.26
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol 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-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol?
The IUPAC name of 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol (CID 164654563) is 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol.
What is the SMILES notation for 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol?
The canonical SMILES for 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol is OC(Cc1cccs1)[C@@H]1CCNC1.
What is the InChIKey of 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol?
The InChIKey is LUSBRBYRJKGFKS-HNHGDDPOSA-N. The full InChI is InChI=1S/C10H15NOS/c12-10(8-3-4-11-7-8)6-9-2-1-5-13-9/h1-2,5,8,10-12H,3-4,6-7H2/t8-,10?/m1/s1.
What are the key properties of 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol?
1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol has a molecular weight of 197.30 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol is sourced from PubChem (CID 164654563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).