N-methylazetidine-3-sulfonamide

C4H10N2O2S — CID 117273967

IUPACN-methylazetidine-3-sulfonamide
SMILESCNS(=O)(=O)C1CNC1
InChIInChI=1S/C4H10N2O2S/c1-5-9(7,8)4-2-6-3-4/h4-6H,2-3H2,1H3
InChIKeyXXZYVWUBYWEWGI-UHFFFAOYSA-N
MW150.20 g/mol
LogP-1.49
Rot. Bonds2

About N-methylazetidine-3-sulfonamide

N-methylazetidine-3-sulfonamide (PubChem CID 117273967) has the molecular formula C4H10N2O2S and a molecular weight of 150.20 g/mol. Its IUPAC name is N-methylazetidine-3-sulfonamide.

Molecular Properties

Compound NameN-methylazetidine-3-sulfonamide
PubChem CID117273967
Molecular FormulaC4H10N2O2S
Molecular Weight150.20 g/mol
Exact Mass150.05
IUPAC NameN-methylazetidine-3-sulfonamide
SMILESCNS(=O)(=O)C1CNC1
InChIInChI=1S/C4H10N2O2S/c1-5-9(7,8)4-2-6-3-4/h4-6H,2-3H2,1H3
InChIKeyXXZYVWUBYWEWGI-UHFFFAOYSA-N
XLogP-1.49
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.20
LogP ≤ 5-1.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methylazetidine-3-sulfonamide?
The IUPAC name of N-methylazetidine-3-sulfonamide (CID 117273967) is N-methylazetidine-3-sulfonamide.
What is the SMILES notation for N-methylazetidine-3-sulfonamide?
The canonical SMILES for N-methylazetidine-3-sulfonamide is CNS(=O)(=O)C1CNC1.
What is the InChIKey of N-methylazetidine-3-sulfonamide?
The InChIKey is XXZYVWUBYWEWGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2S/c1-5-9(7,8)4-2-6-3-4/h4-6H,2-3H2,1H3.
What are the key properties of N-methylazetidine-3-sulfonamide?
N-methylazetidine-3-sulfonamide has a molecular weight of 150.20 g/mol, XLogP of -1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylazetidine-3-sulfonamide is sourced from PubChem (CID 117273967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).