N-benzyl-N-methylethenesulfonamide

C10H13NO2S — CID 22164695

IUPACN-benzyl-N-methylethenesulfonamide
SMILESC=CS(=O)(=O)N(C)Cc1ccccc1
InChIInChI=1S/C10H13NO2S/c1-3-14(12,13)11(2)9-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3
InChIKeyJWWZOPACIXFBKR-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.59
Rot. Bonds4

About N-benzyl-N-methylethenesulfonamide

N-benzyl-N-methylethenesulfonamide (PubChem CID 22164695) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is N-benzyl-N-methylethenesulfonamide.

Molecular Properties

Compound NameN-benzyl-N-methylethenesulfonamide
PubChem CID22164695
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC NameN-benzyl-N-methylethenesulfonamide
SMILESC=CS(=O)(=O)N(C)Cc1ccccc1
InChIInChI=1S/C10H13NO2S/c1-3-14(12,13)11(2)9-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3
InChIKeyJWWZOPACIXFBKR-UHFFFAOYSA-N
XLogP1.59
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methylethenesulfonamide?
The IUPAC name of N-benzyl-N-methylethenesulfonamide (CID 22164695) is N-benzyl-N-methylethenesulfonamide.
What is the SMILES notation for N-benzyl-N-methylethenesulfonamide?
The canonical SMILES for N-benzyl-N-methylethenesulfonamide is C=CS(=O)(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methylethenesulfonamide?
The InChIKey is JWWZOPACIXFBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c1-3-14(12,13)11(2)9-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3.
What are the key properties of N-benzyl-N-methylethenesulfonamide?
N-benzyl-N-methylethenesulfonamide has a molecular weight of 211.29 g/mol, XLogP of 1.59, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methylethenesulfonamide is sourced from PubChem (CID 22164695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).