2-methyl-1-methylsulfonylpropan-2-amine

C5H13NO2S — CID 75422286

IUPAC2-methyl-1-methylsulfonylpropan-2-amine
SMILESCC(C)(N)CS(C)(=O)=O
InChIInChI=1S/C5H13NO2S/c1-5(2,6)4-9(3,7)8/h4,6H2,1-3H3
InChIKeyOVNBCUGVWGAILZ-UHFFFAOYSA-N
MW151.23 g/mol
LogP-0.23
Rot. Bonds2

About 2-methyl-1-methylsulfonylpropan-2-amine

2-methyl-1-methylsulfonylpropan-2-amine (PubChem CID 75422286) has the molecular formula C5H13NO2S and a molecular weight of 151.23 g/mol. Its IUPAC name is 2-methyl-1-methylsulfonylpropan-2-amine.

Molecular Properties

Compound Name2-methyl-1-methylsulfonylpropan-2-amine
PubChem CID75422286
Molecular FormulaC5H13NO2S
Molecular Weight151.23 g/mol
Exact Mass151.07
IUPAC Name2-methyl-1-methylsulfonylpropan-2-amine
SMILESCC(C)(N)CS(C)(=O)=O
InChIInChI=1S/C5H13NO2S/c1-5(2,6)4-9(3,7)8/h4,6H2,1-3H3
InChIKeyOVNBCUGVWGAILZ-UHFFFAOYSA-N
XLogP-0.23
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.23
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-methylsulfonylpropan-2-amine?
The IUPAC name of 2-methyl-1-methylsulfonylpropan-2-amine (CID 75422286) is 2-methyl-1-methylsulfonylpropan-2-amine.
What is the SMILES notation for 2-methyl-1-methylsulfonylpropan-2-amine?
The canonical SMILES for 2-methyl-1-methylsulfonylpropan-2-amine is CC(C)(N)CS(C)(=O)=O.
What is the InChIKey of 2-methyl-1-methylsulfonylpropan-2-amine?
The InChIKey is OVNBCUGVWGAILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2S/c1-5(2,6)4-9(3,7)8/h4,6H2,1-3H3.
What are the key properties of 2-methyl-1-methylsulfonylpropan-2-amine?
2-methyl-1-methylsulfonylpropan-2-amine has a molecular weight of 151.23 g/mol, XLogP of -0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-methylsulfonylpropan-2-amine is sourced from PubChem (CID 75422286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).