1-aminopropane-2-sulfonamide;hydrochloride

C3H11ClN2O2S — CID 71432993

IUPAC1-aminopropane-2-sulfonamide;hydrochloride
SMILESCC(CN)S(N)(=O)=O.Cl
InChIInChI=1S/C3H10N2O2S.ClH/c1-3(2-4)8(5,6)7;/h3H,2,4H2,1H3,(H2,5,6,7);1H
InChIKeyAVBIKLXDQUBZLP-UHFFFAOYSA-N
MW174.65 g/mol
LogP-0.96
Rot. Bonds2

About 1-aminopropane-2-sulfonamide;hydrochloride

1-aminopropane-2-sulfonamide;hydrochloride (PubChem CID 71432993) has the molecular formula C3H11ClN2O2S and a molecular weight of 174.65 g/mol. Its IUPAC name is 1-aminopropane-2-sulfonamide;hydrochloride.

Molecular Properties

Compound Name1-aminopropane-2-sulfonamide;hydrochloride
PubChem CID71432993
Molecular FormulaC3H11ClN2O2S
Molecular Weight174.65 g/mol
Exact Mass174.02
IUPAC Name1-aminopropane-2-sulfonamide;hydrochloride
SMILESCC(CN)S(N)(=O)=O.Cl
InChIInChI=1S/C3H10N2O2S.ClH/c1-3(2-4)8(5,6)7;/h3H,2,4H2,1H3,(H2,5,6,7);1H
InChIKeyAVBIKLXDQUBZLP-UHFFFAOYSA-N
XLogP-0.96
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.65
LogP ≤ 5-0.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-aminopropane-2-sulfonamide;hydrochloride?
The IUPAC name of 1-aminopropane-2-sulfonamide;hydrochloride (CID 71432993) is 1-aminopropane-2-sulfonamide;hydrochloride.
What is the SMILES notation for 1-aminopropane-2-sulfonamide;hydrochloride?
The canonical SMILES for 1-aminopropane-2-sulfonamide;hydrochloride is CC(CN)S(N)(=O)=O.Cl.
What is the InChIKey of 1-aminopropane-2-sulfonamide;hydrochloride?
The InChIKey is AVBIKLXDQUBZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2O2S.ClH/c1-3(2-4)8(5,6)7;/h3H,2,4H2,1H3,(H2,5,6,7);1H.
What are the key properties of 1-aminopropane-2-sulfonamide;hydrochloride?
1-aminopropane-2-sulfonamide;hydrochloride has a molecular weight of 174.65 g/mol, XLogP of -0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminopropane-2-sulfonamide;hydrochloride is sourced from PubChem (CID 71432993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).