2-amino-N-propan-2-ylethanesulfonamide;hydrochloride

C5H15ClN2O2S — CID 47002472

IUPAC2-amino-N-propan-2-ylethanesulfonamide;hydrochloride
SMILESCC(C)NS(=O)(=O)CCN.Cl
InChIInChI=1S/C5H14N2O2S.ClH/c1-5(2)7-10(8,9)4-3-6;/h5,7H,3-4,6H2,1-2H3;1H
InChIKeyLGEZQXPXEFXKPH-UHFFFAOYSA-N
MW202.71 g/mol
LogP-0.31
Rot. Bonds4

About 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride

2-amino-N-propan-2-ylethanesulfonamide;hydrochloride (PubChem CID 47002472) has the molecular formula C5H15ClN2O2S and a molecular weight of 202.71 g/mol. Its IUPAC name is 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-propan-2-ylethanesulfonamide;hydrochloride
PubChem CID47002472
Molecular FormulaC5H15ClN2O2S
Molecular Weight202.71 g/mol
Exact Mass202.05
IUPAC Name2-amino-N-propan-2-ylethanesulfonamide;hydrochloride
SMILESCC(C)NS(=O)(=O)CCN.Cl
InChIInChI=1S/C5H14N2O2S.ClH/c1-5(2)7-10(8,9)4-3-6;/h5,7H,3-4,6H2,1-2H3;1H
InChIKeyLGEZQXPXEFXKPH-UHFFFAOYSA-N
XLogP-0.31
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.71
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride?
The IUPAC name of 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride (CID 47002472) is 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride.
What is the SMILES notation for 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride?
The canonical SMILES for 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride is CC(C)NS(=O)(=O)CCN.Cl.
What is the InChIKey of 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride?
The InChIKey is LGEZQXPXEFXKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O2S.ClH/c1-5(2)7-10(8,9)4-3-6;/h5,7H,3-4,6H2,1-2H3;1H.
What are the key properties of 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride?
2-amino-N-propan-2-ylethanesulfonamide;hydrochloride has a molecular weight of 202.71 g/mol, XLogP of -0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propan-2-ylethanesulfonamide;hydrochloride is sourced from PubChem (CID 47002472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).