(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride

C5H15ClN2O2S — CID 170163374

IUPAC(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride
SMILESCC(C)[C@H](CN)S(N)(=O)=O.Cl
InChIInChI=1S/C5H14N2O2S.ClH/c1-4(2)5(3-6)10(7,8)9;/h4-5H,3,6H2,1-2H3,(H2,7,8,9);1H/t5-;/m0./s1
InChIKeyTUDHMALZZPXRPV-JEDNCBNOSA-N
MW202.71 g/mol
LogP-0.32
Rot. Bonds3

About (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride

(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride (PubChem CID 170163374) has the molecular formula C5H15ClN2O2S and a molecular weight of 202.71 g/mol. Its IUPAC name is (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride.

Molecular Properties

Compound Name(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride
PubChem CID170163374
Molecular FormulaC5H15ClN2O2S
Molecular Weight202.71 g/mol
Exact Mass202.05
IUPAC Name(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride
SMILESCC(C)[C@H](CN)S(N)(=O)=O.Cl
InChIInChI=1S/C5H14N2O2S.ClH/c1-4(2)5(3-6)10(7,8)9;/h4-5H,3,6H2,1-2H3,(H2,7,8,9);1H/t5-;/m0./s1
InChIKeyTUDHMALZZPXRPV-JEDNCBNOSA-N
XLogP-0.32
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.71
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride?
The IUPAC name of (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride (CID 170163374) is (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride.
What is the SMILES notation for (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride?
The canonical SMILES for (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride is CC(C)[C@H](CN)S(N)(=O)=O.Cl.
What is the InChIKey of (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride?
The InChIKey is TUDHMALZZPXRPV-JEDNCBNOSA-N. The full InChI is InChI=1S/C5H14N2O2S.ClH/c1-4(2)5(3-6)10(7,8)9;/h4-5H,3,6H2,1-2H3,(H2,7,8,9);1H/t5-;/m0./s1.
What are the key properties of (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride?
(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride has a molecular weight of 202.71 g/mol, XLogP of -0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride is sourced from PubChem (CID 170163374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).