2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol

C10H19NO3S — CID 79543629

IUPAC2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
SMILESCS(=O)(=O)N1CCCC1C1CCCC1O
InChIInChI=1S/C10H19NO3S/c1-15(13,14)11-7-3-5-9(11)8-4-2-6-10(8)12/h8-10,12H,2-7H2,1H3
InChIKeySYXMETPDGWHRMR-UHFFFAOYSA-N
MW233.33 g/mol
LogP0.57
Rot. Bonds2

About 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol

2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol (PubChem CID 79543629) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
PubChem CID79543629
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC Name2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol
SMILESCS(=O)(=O)N1CCCC1C1CCCC1O
InChIInChI=1S/C10H19NO3S/c1-15(13,14)11-7-3-5-9(11)8-4-2-6-10(8)12/h8-10,12H,2-7H2,1H3
InChIKeySYXMETPDGWHRMR-UHFFFAOYSA-N
XLogP0.57
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
The IUPAC name of 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol (CID 79543629) is 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol.
What is the SMILES notation for 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
The canonical SMILES for 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol is CS(=O)(=O)N1CCCC1C1CCCC1O.
What is the InChIKey of 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
The InChIKey is SYXMETPDGWHRMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3S/c1-15(13,14)11-7-3-5-9(11)8-4-2-6-10(8)12/h8-10,12H,2-7H2,1H3.
What are the key properties of 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol?
2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol has a molecular weight of 233.33 g/mol, XLogP of 0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylsulfonylpyrrolidin-2-yl)cyclopentan-1-ol is sourced from PubChem (CID 79543629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).