3-aminoprop-1-ene-1-sulfonamide

C3H8N2O2S — CID 87526420

IUPAC3-aminoprop-1-ene-1-sulfonamide
SMILESNCC=CS(N)(=O)=O
InChIInChI=1S/C3H8N2O2S/c4-2-1-3-8(5,6)7/h1,3H,2,4H2,(H2,5,6,7)
InChIKeyWMVQNIKRCAUWHT-UHFFFAOYSA-N
MW136.18 g/mol
LogP-1.25
Rot. Bonds2

About 3-aminoprop-1-ene-1-sulfonamide

3-aminoprop-1-ene-1-sulfonamide (PubChem CID 87526420) has the molecular formula C3H8N2O2S and a molecular weight of 136.18 g/mol. Its IUPAC name is 3-aminoprop-1-ene-1-sulfonamide.

Molecular Properties

Compound Name3-aminoprop-1-ene-1-sulfonamide
PubChem CID87526420
Molecular FormulaC3H8N2O2S
Molecular Weight136.18 g/mol
Exact Mass136.03
IUPAC Name3-aminoprop-1-ene-1-sulfonamide
SMILESNCC=CS(N)(=O)=O
InChIInChI=1S/C3H8N2O2S/c4-2-1-3-8(5,6)7/h1,3H,2,4H2,(H2,5,6,7)
InChIKeyWMVQNIKRCAUWHT-UHFFFAOYSA-N
XLogP-1.25
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.18
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-aminoprop-1-ene-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-3-aminoprop-1-ene-1-sulfonic acid
CID 87091905
penta-1,4-diene-1-sulfonamide
CID 174872703
methyl (E)-3-aminoprop-1-ene-1-sulfonate
CID 135138121
3-aminoprop-1-ene-1-thiol
CID 173002816
3-aminoprop-1-enyl methanesulfonate
CID 173361651
3-sulfamoylprop-2-enamide
CID 142050789
(Z)-2-nitroethenesulfonamide
CID 59716481
ethenesulfonamide
CID 520075
hepta-2,5-diene-1,7-diamine
CID 56638039
5-(3-aminoprop-1-enyl)thiophene-2-sulfonamide
CID 169463635
1-but-1-enylsulfonylbut-1-ene
CID 123705607
(E)-4-amino-N-methylsulfonylbut-2-enamide
CID 130533357

Frequently Asked Questions

What is the IUPAC name of 3-aminoprop-1-ene-1-sulfonamide?
The IUPAC name of 3-aminoprop-1-ene-1-sulfonamide (CID 87526420) is 3-aminoprop-1-ene-1-sulfonamide.
What is the SMILES notation for 3-aminoprop-1-ene-1-sulfonamide?
The canonical SMILES for 3-aminoprop-1-ene-1-sulfonamide is NCC=CS(N)(=O)=O.
What is the InChIKey of 3-aminoprop-1-ene-1-sulfonamide?
The InChIKey is WMVQNIKRCAUWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O2S/c4-2-1-3-8(5,6)7/h1,3H,2,4H2,(H2,5,6,7).
What are the key properties of 3-aminoprop-1-ene-1-sulfonamide?
3-aminoprop-1-ene-1-sulfonamide has a molecular weight of 136.18 g/mol, XLogP of -1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminoprop-1-ene-1-sulfonamide is sourced from PubChem (CID 87526420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).