(3S)-N-methyloxolane-3-sulfonamide

C5H11NO3S — CID 97167961

IUPAC(3S)-N-methyloxolane-3-sulfonamide
SMILESCNS(=O)(=O)[C@H]1CCOC1
InChIInChI=1S/C5H11NO3S/c1-6-10(7,8)5-2-3-9-4-5/h5-6H,2-4H2,1H3/t5-/m0/s1
InChIKeyBVHHQZBAPPRWMJ-YFKPBYRVSA-N
MW165.21 g/mol
LogP-0.68
Rot. Bonds2

About (3S)-N-methyloxolane-3-sulfonamide

(3S)-N-methyloxolane-3-sulfonamide (PubChem CID 97167961) has the molecular formula C5H11NO3S and a molecular weight of 165.21 g/mol. Its IUPAC name is (3S)-N-methyloxolane-3-sulfonamide.

Molecular Properties

Compound Name(3S)-N-methyloxolane-3-sulfonamide
PubChem CID97167961
Molecular FormulaC5H11NO3S
Molecular Weight165.21 g/mol
Exact Mass165.05
IUPAC Name(3S)-N-methyloxolane-3-sulfonamide
SMILESCNS(=O)(=O)[C@H]1CCOC1
InChIInChI=1S/C5H11NO3S/c1-6-10(7,8)5-2-3-9-4-5/h5-6H,2-4H2,1H3/t5-/m0/s1
InChIKeyBVHHQZBAPPRWMJ-YFKPBYRVSA-N
XLogP-0.68
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 5-0.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3S)-N-methyloxolane-3-sulfonamide?
The IUPAC name of (3S)-N-methyloxolane-3-sulfonamide (CID 97167961) is (3S)-N-methyloxolane-3-sulfonamide.
What is the SMILES notation for (3S)-N-methyloxolane-3-sulfonamide?
The canonical SMILES for (3S)-N-methyloxolane-3-sulfonamide is CNS(=O)(=O)[C@H]1CCOC1.
What is the InChIKey of (3S)-N-methyloxolane-3-sulfonamide?
The InChIKey is BVHHQZBAPPRWMJ-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H11NO3S/c1-6-10(7,8)5-2-3-9-4-5/h5-6H,2-4H2,1H3/t5-/m0/s1.
What are the key properties of (3S)-N-methyloxolane-3-sulfonamide?
(3S)-N-methyloxolane-3-sulfonamide has a molecular weight of 165.21 g/mol, XLogP of -0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-methyloxolane-3-sulfonamide is sourced from PubChem (CID 97167961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).