(3S)-1-propylsulfonylpyrrolidin-3-ol

C7H15NO3S — CID 64723970

IUPAC(3S)-1-propylsulfonylpyrrolidin-3-ol
SMILESCCCS(=O)(=O)N1CC[C@H](O)C1
InChIInChI=1S/C7H15NO3S/c1-2-5-12(10,11)8-4-3-7(9)6-8/h7,9H,2-6H2,1H3/t7-/m0/s1
InChIKeyRYZPTCCLDMJKNG-ZETCQYMHSA-N
MW193.27 g/mol
LogP-0.21
Rot. Bonds3

About (3S)-1-propylsulfonylpyrrolidin-3-ol

(3S)-1-propylsulfonylpyrrolidin-3-ol (PubChem CID 64723970) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is (3S)-1-propylsulfonylpyrrolidin-3-ol.

Molecular Properties

Compound Name(3S)-1-propylsulfonylpyrrolidin-3-ol
PubChem CID64723970
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC Name(3S)-1-propylsulfonylpyrrolidin-3-ol
SMILESCCCS(=O)(=O)N1CC[C@H](O)C1
InChIInChI=1S/C7H15NO3S/c1-2-5-12(10,11)8-4-3-7(9)6-8/h7,9H,2-6H2,1H3/t7-/m0/s1
InChIKeyRYZPTCCLDMJKNG-ZETCQYMHSA-N
XLogP-0.21
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-propylsulfonylpyrrolidin-3-ol
CID 62916606
1-(2-aminoethylsulfonyl)pyrrolidin-3-ol
CID 62941538
(3S)-1-(3-methoxypropylsulfonyl)pyrrolidin-3-ol
CID 66291110
1-(methylsulfonylmethylsulfonyl)pyrrolidin-3-ol
CID 82843149
(3R)-1-methylsulfonylpyrrolidin-3-ol
CID 78998740
1-methylsulfonylpyrrolidin-3-ol
CID 20745843
1-[4-(1-propylsulfonylpyrrolidin-3-yl)piperidin-1-yl]ethanone
CID 91921325
3-(2,2-dimethylpropyl)-1-propylsulfonylpyrrolidine
CID 164775491
ethyl 2-(3-hydroxypyrrolidin-1-yl)sulfonylacetate
CID 62917298
(3S)-N,N-diethyl-3-hydroxypyrrolidine-1-sulfonamide
CID 79031251
4-(methylsulfonylmethyl)-1-propylsulfonylpiperidine
CID 110736097
1-(3-methylbutylsulfonyl)piperidin-3-ol
CID 63856067

Frequently Asked Questions

What is the IUPAC name of (3S)-1-propylsulfonylpyrrolidin-3-ol?
The IUPAC name of (3S)-1-propylsulfonylpyrrolidin-3-ol (CID 64723970) is (3S)-1-propylsulfonylpyrrolidin-3-ol.
What is the SMILES notation for (3S)-1-propylsulfonylpyrrolidin-3-ol?
The canonical SMILES for (3S)-1-propylsulfonylpyrrolidin-3-ol is CCCS(=O)(=O)N1CC[C@H](O)C1.
What is the InChIKey of (3S)-1-propylsulfonylpyrrolidin-3-ol?
The InChIKey is RYZPTCCLDMJKNG-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-2-5-12(10,11)8-4-3-7(9)6-8/h7,9H,2-6H2,1H3/t7-/m0/s1.
What are the key properties of (3S)-1-propylsulfonylpyrrolidin-3-ol?
(3S)-1-propylsulfonylpyrrolidin-3-ol has a molecular weight of 193.27 g/mol, XLogP of -0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-propylsulfonylpyrrolidin-3-ol is sourced from PubChem (CID 64723970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).