2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide

C7H17NO3S — CID 164831486

IUPAC2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide
SMILESCOCCS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C7H17NO3S/c1-7(2)8(3)12(9,10)6-5-11-4/h7H,5-6H2,1-4H3
InChIKeyCPEXWNRHNZADCD-UHFFFAOYSA-N
MW195.28 g/mol
LogP0.30
Rot. Bonds5

About 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide

2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide (PubChem CID 164831486) has the molecular formula C7H17NO3S and a molecular weight of 195.28 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide
PubChem CID164831486
Molecular FormulaC7H17NO3S
Molecular Weight195.28 g/mol
Exact Mass195.09
IUPAC Name2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide
SMILESCOCCS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C7H17NO3S/c1-7(2)8(3)12(9,10)6-5-11-4/h7H,5-6H2,1-4H3
InChIKeyCPEXWNRHNZADCD-UHFFFAOYSA-N
XLogP0.30
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.28
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide 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 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide?
The IUPAC name of 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide (CID 164831486) is 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide.
What is the SMILES notation for 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide?
The canonical SMILES for 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide is COCCS(=O)(=O)N(C)C(C)C.
What is the InChIKey of 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide?
The InChIKey is CPEXWNRHNZADCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO3S/c1-7(2)8(3)12(9,10)6-5-11-4/h7H,5-6H2,1-4H3.
What are the key properties of 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide?
2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide has a molecular weight of 195.28 g/mol, XLogP of 0.30, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-propan-2-ylethanesulfonamide is sourced from PubChem (CID 164831486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).