[1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol

C6H10F3NO3S — CID 61409066

IUPAC[1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol
SMILESO=S(=O)(N1CCCC1CO)C(F)(F)F
InChIInChI=1S/C6H10F3NO3S/c7-6(8,9)14(12,13)10-3-1-2-5(10)4-11/h5,11H,1-4H2
InChIKeyGEYPUXIREWDXOM-UHFFFAOYSA-N
MW233.21 g/mol
LogP0.29
Rot. Bonds2

About [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol

[1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol (PubChem CID 61409066) has the molecular formula C6H10F3NO3S and a molecular weight of 233.21 g/mol. Its IUPAC name is [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol
PubChem CID61409066
Molecular FormulaC6H10F3NO3S
Molecular Weight233.21 g/mol
Exact Mass233.03
IUPAC Name[1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol
SMILESO=S(=O)(N1CCCC1CO)C(F)(F)F
InChIInChI=1S/C6H10F3NO3S/c7-6(8,9)14(12,13)10-3-1-2-5(10)4-11/h5,11H,1-4H2
InChIKeyGEYPUXIREWDXOM-UHFFFAOYSA-N
XLogP0.29
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.21
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(trifluoromethylsulfonyl)pyrrolidin-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

Frequently Asked Questions

What is the IUPAC name of [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol (CID 61409066) is [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol is O=S(=O)(N1CCCC1CO)C(F)(F)F.
What is the InChIKey of [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol?
The InChIKey is GEYPUXIREWDXOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO3S/c7-6(8,9)14(12,13)10-3-1-2-5(10)4-11/h5,11H,1-4H2.
What are the key properties of [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol?
[1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol has a molecular weight of 233.21 g/mol, XLogP of 0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(trifluoromethylsulfonyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 61409066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).