2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol

C13H19NO3S2 — CID 79543711

IUPAC2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
SMILESO=S(=O)(c1cccs1)N1CCCC1C1CCCC1O
InChIInChI=1S/C13H19NO3S2/c15-12-6-1-4-10(12)11-5-2-8-14(11)19(16,17)13-7-3-9-18-13/h3,7,9-12,15H,1-2,4-6,8H2
InChIKeyQMEPLAVZUHHKGU-UHFFFAOYSA-N
MW301.43 g/mol
LogP2.06
Rot. Bonds3

About 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol

2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol (PubChem CID 79543711) has the molecular formula C13H19NO3S2 and a molecular weight of 301.43 g/mol. Its IUPAC name is 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
PubChem CID79543711
Molecular FormulaC13H19NO3S2
Molecular Weight301.43 g/mol
Exact Mass301.08
IUPAC Name2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
SMILESO=S(=O)(c1cccs1)N1CCCC1C1CCCC1O
InChIInChI=1S/C13H19NO3S2/c15-12-6-1-4-10(12)11-5-2-8-14(11)19(16,17)13-7-3-9-18-13/h3,7,9-12,15H,1-2,4-6,8H2
InChIKeyQMEPLAVZUHHKGU-UHFFFAOYSA-N
XLogP2.06
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanol
CID 61408705
2-propan-2-yl-1-thiophen-2-ylsulfonylpyrrolidine
CID 110728294
2-[1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]cyclopentan-1-ol
CID 79539682
(2S)-1-thiophen-2-ylsulfonylpiperidine-2-carbonyl chloride
CID 42281719
N'-hydroxy-1-thiophen-2-ylsulfonylpiperidine-2-carboximidamide
CID 77041831
(2S)-N-(2-acetamidoethyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 94799718
(2R)-N-(2-acetamidoethyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 94799719
N-cyclohexyl-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 110285845
N-(3-aminopropyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 119405132
1-phenyl-2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)ethanol
CID 71911232
N-[(4-methylphenyl)methyl]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 71684075
(2R)-N-(4-chlorophenyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
CID 7614814

Frequently Asked Questions

What is the IUPAC name of 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
The IUPAC name of 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol (CID 79543711) is 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol.
What is the SMILES notation for 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
The canonical SMILES for 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol is O=S(=O)(c1cccs1)N1CCCC1C1CCCC1O.
What is the InChIKey of 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
The InChIKey is QMEPLAVZUHHKGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3S2/c15-12-6-1-4-10(12)11-5-2-8-14(11)19(16,17)13-7-3-9-18-13/h3,7,9-12,15H,1-2,4-6,8H2.
What are the key properties of 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol has a molecular weight of 301.43 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol is sourced from PubChem (CID 79543711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).