1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol

C16H19NO3S2 — CID 71911232

IUPAC1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol
SMILESO=S(=O)(c1cccs1)N1CCCC1CC(O)c1ccccc1
InChIInChI=1S/C16H19NO3S2/c18-15(13-6-2-1-3-7-13)12-14-8-4-10-17(14)22(19,20)16-9-5-11-21-16/h1-3,5-7,9,11,14-15,18H,4,8,10,12H2
InChIKeyZAZDAUBGWWRUDM-UHFFFAOYSA-N
MW337.47 g/mol
LogP3.02
Rot. Bonds5

About 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol

1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol (PubChem CID 71911232) has the molecular formula C16H19NO3S2 and a molecular weight of 337.47 g/mol. Its IUPAC name is 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol.

Molecular Properties

Compound Name1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol
PubChem CID71911232
Molecular FormulaC16H19NO3S2
Molecular Weight337.47 g/mol
Exact Mass337.08
IUPAC Name1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol
SMILESO=S(=O)(c1cccs1)N1CCCC1CC(O)c1ccccc1
InChIInChI=1S/C16H19NO3S2/c18-15(13-6-2-1-3-7-13)12-14-8-4-10-17(14)22(19,20)16-9-5-11-21-16/h1-3,5-7,9,11,14-15,18H,4,8,10,12H2
InChIKeyZAZDAUBGWWRUDM-UHFFFAOYSA-N
XLogP3.02
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol 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-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol
CID 61408705
2-(2-hydroxy-2-phenylethyl)pyrrolidine-1-sulfonamide
CID 71989179
2-(2-chloropropyl)-1-thiophen-2-ylsulfonylazepane
CID 112748624
N'-phenyl-N-[[(2S)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]oxamide
CID 7286397
N-methyl-N'-[[(2S)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]oxamide
CID 7286403
(1S)-2-[(2R)-1-(2-methylpyrazol-3-yl)sulfonylpyrrolidin-2-yl]-1-thiophen-2-ylethanol
CID 124739947
2-propan-2-yl-1-thiophen-2-ylsulfonylpyrrolidine
CID 110728294
[1-(3-thiophen-2-ylsulfonylphenyl)sulfonylpyrrolidin-2-yl]methanol
CID 175606970
2,6-dimethyl-4-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methyl]morpholine
CID 47813945
N'-(2,2-dimethoxyethyl)-N-[[(2R)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]methyl]oxamide
CID 41222980
2-(2-hydroxy-2-phenylethyl)-N-(thiophen-2-ylmethyl)pyrrolidine-1-carboxamide
CID 111476043
2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
CID 79543711

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol?
The IUPAC name of 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol (CID 71911232) is 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol.
What is the SMILES notation for 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol?
The canonical SMILES for 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol is O=S(=O)(c1cccs1)N1CCCC1CC(O)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol?
The InChIKey is ZAZDAUBGWWRUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3S2/c18-15(13-6-2-1-3-7-13)12-14-8-4-10-17(14)22(19,20)16-9-5-11-21-16/h1-3,5-7,9,11,14-15,18H,4,8,10,12H2.
What are the key properties of 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol?
1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol has a molecular weight of 337.47 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol is sourced from PubChem (CID 71911232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).