N-methyl-N-propan-2-ylmethanesulfonamide

C5H13NO2S — CID 23532186

IUPACN-methyl-N-propan-2-ylmethanesulfonamide
SMILESCC(C)N(C)S(C)(=O)=O
InChIInChI=1S/C5H13NO2S/c1-5(2)6(3)9(4,7)8/h5H,1-4H3
InChIKeyFTNJEMBLYVWDKZ-UHFFFAOYSA-N
MW151.23 g/mol
LogP0.29
Rot. Bonds2

About N-methyl-N-propan-2-ylmethanesulfonamide

N-methyl-N-propan-2-ylmethanesulfonamide (PubChem CID 23532186) has the molecular formula C5H13NO2S and a molecular weight of 151.23 g/mol. Its IUPAC name is N-methyl-N-propan-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-ylmethanesulfonamide
PubChem CID23532186
Molecular FormulaC5H13NO2S
Molecular Weight151.23 g/mol
Exact Mass151.07
IUPAC NameN-methyl-N-propan-2-ylmethanesulfonamide
SMILESCC(C)N(C)S(C)(=O)=O
InChIInChI=1S/C5H13NO2S/c1-5(2)6(3)9(4,7)8/h5H,1-4H3
InChIKeyFTNJEMBLYVWDKZ-UHFFFAOYSA-N
XLogP0.29
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.23
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-ylmethanesulfonamide?
The IUPAC name of N-methyl-N-propan-2-ylmethanesulfonamide (CID 23532186) is N-methyl-N-propan-2-ylmethanesulfonamide.
What is the SMILES notation for N-methyl-N-propan-2-ylmethanesulfonamide?
The canonical SMILES for N-methyl-N-propan-2-ylmethanesulfonamide is CC(C)N(C)S(C)(=O)=O.
What is the InChIKey of N-methyl-N-propan-2-ylmethanesulfonamide?
The InChIKey is FTNJEMBLYVWDKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2S/c1-5(2)6(3)9(4,7)8/h5H,1-4H3.
What are the key properties of N-methyl-N-propan-2-ylmethanesulfonamide?
N-methyl-N-propan-2-ylmethanesulfonamide has a molecular weight of 151.23 g/mol, XLogP of 0.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-ylmethanesulfonamide is sourced from PubChem (CID 23532186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).