2-amino-N,N-dimethylpropane-1-sulfonamide

C5H14N2O2S — CID 82074759

IUPAC2-amino-N,N-dimethylpropane-1-sulfonamide
SMILESCC(N)CS(=O)(=O)N(C)C
InChIInChI=1S/C5H14N2O2S/c1-5(6)4-10(8,9)7(2)3/h5H,4,6H2,1-3H3
InChIKeyHNXKPJCKCHQTRU-UHFFFAOYSA-N
MW166.25 g/mol
LogP-0.77
Rot. Bonds3

About 2-amino-N,N-dimethylpropane-1-sulfonamide

2-amino-N,N-dimethylpropane-1-sulfonamide (PubChem CID 82074759) has the molecular formula C5H14N2O2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 2-amino-N,N-dimethylpropane-1-sulfonamide.

Molecular Properties

Compound Name2-amino-N,N-dimethylpropane-1-sulfonamide
PubChem CID82074759
Molecular FormulaC5H14N2O2S
Molecular Weight166.25 g/mol
Exact Mass166.08
IUPAC Name2-amino-N,N-dimethylpropane-1-sulfonamide
SMILESCC(N)CS(=O)(=O)N(C)C
InChIInChI=1S/C5H14N2O2S/c1-5(6)4-10(8,9)7(2)3/h5H,4,6H2,1-3H3
InChIKeyHNXKPJCKCHQTRU-UHFFFAOYSA-N
XLogP-0.77
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 5-0.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,N-dimethylpropane-1-sulfonamide?
The IUPAC name of 2-amino-N,N-dimethylpropane-1-sulfonamide (CID 82074759) is 2-amino-N,N-dimethylpropane-1-sulfonamide.
What is the SMILES notation for 2-amino-N,N-dimethylpropane-1-sulfonamide?
The canonical SMILES for 2-amino-N,N-dimethylpropane-1-sulfonamide is CC(N)CS(=O)(=O)N(C)C.
What is the InChIKey of 2-amino-N,N-dimethylpropane-1-sulfonamide?
The InChIKey is HNXKPJCKCHQTRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O2S/c1-5(6)4-10(8,9)7(2)3/h5H,4,6H2,1-3H3.
What are the key properties of 2-amino-N,N-dimethylpropane-1-sulfonamide?
2-amino-N,N-dimethylpropane-1-sulfonamide has a molecular weight of 166.25 g/mol, XLogP of -0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,N-dimethylpropane-1-sulfonamide is sourced from PubChem (CID 82074759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).