3-aminopropane-1-sulfonamide

C3H10N2O2S — CID 13343446

IUPAC3-aminopropane-1-sulfonamide
SMILESNCCCS(N)(=O)=O
InChIInChI=1S/C3H10N2O2S/c4-2-1-3-8(5,6)7/h1-4H2,(H2,5,6,7)
InChIKeySNGRYJSFEVUFBF-UHFFFAOYSA-N
MW138.19 g/mol
LogP-1.38
Rot. Bonds3

About 3-aminopropane-1-sulfonamide

3-aminopropane-1-sulfonamide (PubChem CID 13343446) has the molecular formula C3H10N2O2S and a molecular weight of 138.19 g/mol. Its IUPAC name is 3-aminopropane-1-sulfonamide.

Molecular Properties

Compound Name3-aminopropane-1-sulfonamide
PubChem CID13343446
Molecular FormulaC3H10N2O2S
Molecular Weight138.19 g/mol
Exact Mass138.05
IUPAC Name3-aminopropane-1-sulfonamide
SMILESNCCCS(N)(=O)=O
InChIInChI=1S/C3H10N2O2S/c4-2-1-3-8(5,6)7/h1-4H2,(H2,5,6,7)
InChIKeySNGRYJSFEVUFBF-UHFFFAOYSA-N
XLogP-1.38
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.19
LogP ≤ 5-1.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Tramiprosate
CID 1646
2-Ammonioethanesulfonate
CID 4068592
Tramiprosate Sodium
CID 23663660
2-Aminoethanesulfonate
CID 5460761
3-Azaniumylpropane-1-sulfonate
CID 6991996
2-(2-Aminoethylsulfonylsulfanyl)ethanamine
CID 437876
Taurinamide
CID 101263
3-Aminopropane-1-sulfonate
CID 3578030
4-amino-N-methylbutane-1-sulfonamide
CID 61456555
2-Aminoethanesulphonamide monohydrochloride
CID 3021549
3-amino-N-hydroxypropane-1-sulfonamide;hydrobromide
CID 45260204
N-ethylethane-1-sulfonamide
CID 3302035

Frequently Asked Questions

What is the IUPAC name of 3-aminopropane-1-sulfonamide?
The IUPAC name of 3-aminopropane-1-sulfonamide (CID 13343446) is 3-aminopropane-1-sulfonamide.
What is the SMILES notation for 3-aminopropane-1-sulfonamide?
The canonical SMILES for 3-aminopropane-1-sulfonamide is NCCCS(N)(=O)=O.
What is the InChIKey of 3-aminopropane-1-sulfonamide?
The InChIKey is SNGRYJSFEVUFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2O2S/c4-2-1-3-8(5,6)7/h1-4H2,(H2,5,6,7).
What are the key properties of 3-aminopropane-1-sulfonamide?
3-aminopropane-1-sulfonamide has a molecular weight of 138.19 g/mol, XLogP of -1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminopropane-1-sulfonamide is sourced from PubChem (CID 13343446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).