N-methyl-N-prop-2-enylethenesulfonamide

C6H11NO2S — CID 134859531

IUPACN-methyl-N-prop-2-enylethenesulfonamide
SMILESC=CCN(C)S(=O)(=O)C=C
InChIInChI=1S/C6H11NO2S/c1-4-6-7(3)10(8,9)5-2/h4-5H,1-2,6H2,3H3
InChIKeyVDIXKXAUGPXDQN-UHFFFAOYSA-N
MW161.23 g/mol
LogP0.58
Rot. Bonds4

About N-methyl-N-prop-2-enylethenesulfonamide

N-methyl-N-prop-2-enylethenesulfonamide (PubChem CID 134859531) has the molecular formula C6H11NO2S and a molecular weight of 161.23 g/mol. Its IUPAC name is N-methyl-N-prop-2-enylethenesulfonamide.

Molecular Properties

Compound NameN-methyl-N-prop-2-enylethenesulfonamide
PubChem CID134859531
Molecular FormulaC6H11NO2S
Molecular Weight161.23 g/mol
Exact Mass161.05
IUPAC NameN-methyl-N-prop-2-enylethenesulfonamide
SMILESC=CCN(C)S(=O)(=O)C=C
InChIInChI=1S/C6H11NO2S/c1-4-6-7(3)10(8,9)5-2/h4-5H,1-2,6H2,3H3
InChIKeyVDIXKXAUGPXDQN-UHFFFAOYSA-N
XLogP0.58
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.23
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-methyl-N-prop-2-enylethenesulfonamide 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 N-methyl-N-prop-2-enylethenesulfonamide?
The IUPAC name of N-methyl-N-prop-2-enylethenesulfonamide (CID 134859531) is N-methyl-N-prop-2-enylethenesulfonamide.
What is the SMILES notation for N-methyl-N-prop-2-enylethenesulfonamide?
The canonical SMILES for N-methyl-N-prop-2-enylethenesulfonamide is C=CCN(C)S(=O)(=O)C=C.
What is the InChIKey of N-methyl-N-prop-2-enylethenesulfonamide?
The InChIKey is VDIXKXAUGPXDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2S/c1-4-6-7(3)10(8,9)5-2/h4-5H,1-2,6H2,3H3.
What are the key properties of N-methyl-N-prop-2-enylethenesulfonamide?
N-methyl-N-prop-2-enylethenesulfonamide has a molecular weight of 161.23 g/mol, XLogP of 0.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-2-enylethenesulfonamide is sourced from PubChem (CID 134859531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).