(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol

C9H13NO3S2 — CID 61408705

IUPAC(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol
SMILESO=S(=O)(c1cccs1)N1CCCC1CO
InChIInChI=1S/C9H13NO3S2/c11-7-8-3-1-5-10(8)15(12,13)9-4-2-6-14-9/h2,4,6,8,11H,1,3,5,7H2
InChIKeyZXCDFONPRNOARD-UHFFFAOYSA-N
MW247.34 g/mol
LogP0.89
Rot. Bonds3

About (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol

(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol (PubChem CID 61408705) has the molecular formula C9H13NO3S2 and a molecular weight of 247.34 g/mol. Its IUPAC name is (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol.

Molecular Properties

Compound Name(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol
PubChem CID61408705
Molecular FormulaC9H13NO3S2
Molecular Weight247.34 g/mol
Exact Mass247.03
IUPAC Name(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol
SMILESO=S(=O)(c1cccs1)N1CCCC1CO
InChIInChI=1S/C9H13NO3S2/c11-7-8-3-1-5-10(8)15(12,13)9-4-2-6-14-9/h2,4,6,8,11H,1,3,5,7H2
InChIKeyZXCDFONPRNOARD-UHFFFAOYSA-N
XLogP0.89
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1-thiophen-2-ylsulfonylpyrrolidin-2-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

Related Compounds

[1-(3-thiophen-2-ylsulfonylphenyl)sulfonylpyrrolidin-2-yl]methanol
CID 175606970
1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol
CID 71911232
N-methyl-N'-[[(2S)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]oxamide
CID 7286403
2,6-dimethyl-4-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methyl]morpholine
CID 47813945
2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
CID 79543711
2-(2-chloropropyl)-1-thiophen-2-ylsulfonylazepane
CID 112748624
N'-phenyl-N-[[(2S)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]oxamide
CID 7286397
4-fluoro-N-[[(2R)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]benzamide
CID 7286373
N-cyclohexyl-2-[(2S)-1-thiophen-2-ylsulfonylpiperidin-2-yl]acetamide
CID 26562522
2-propan-2-yl-1-thiophen-2-ylsulfonylpyrrolidine
CID 110728294
N'-hydroxy-1-thiophen-2-ylsulfonylpiperidine-2-carboximidamide
CID 77041831
N'-(2,2-dimethoxyethyl)-N-[[(2R)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]oxamide
CID 41222980

Frequently Asked Questions

What is the IUPAC name of (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol?
The IUPAC name of (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol (CID 61408705) is (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol.
What is the SMILES notation for (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol?
The canonical SMILES for (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol is O=S(=O)(c1cccs1)N1CCCC1CO.
What is the InChIKey of (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol?
The InChIKey is ZXCDFONPRNOARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3S2/c11-7-8-3-1-5-10(8)15(12,13)9-4-2-6-14-9/h2,4,6,8,11H,1,3,5,7H2.
What are the key properties of (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol?
(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol has a molecular weight of 247.34 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol is sourced from PubChem (CID 61408705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).