methanamine;sulfamic acid

CH8N2O3S — CID 173241578

IUPACmethanamine;sulfamic acid
SMILESCN.NS(=O)(=O)O
InChIInChI=1S/CH5N.H3NO3S/c1-2;1-5(2,3)4/h2H2,1H3;(H3,1,2,3,4)
InChIKeyGBJIYBJBUORQNK-UHFFFAOYSA-N
MW128.15 g/mol
LogP-1.68
Rot. Bonds

About methanamine;sulfamic acid

methanamine;sulfamic acid (PubChem CID 173241578) has the molecular formula CH8N2O3S and a molecular weight of 128.15 g/mol. Its IUPAC name is methanamine;sulfamic acid.

Molecular Properties

Compound Namemethanamine;sulfamic acid
PubChem CID173241578
Molecular FormulaCH8N2O3S
Molecular Weight128.15 g/mol
Exact Mass128.03
IUPAC Namemethanamine;sulfamic acid
SMILESCN.NS(=O)(=O)O
InChIInChI=1S/CH5N.H3NO3S/c1-2;1-5(2,3)4/h2H2,1H3;(H3,1,2,3,4)
InChIKeyGBJIYBJBUORQNK-UHFFFAOYSA-N
XLogP-1.68
TPSA106.41 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 5-1.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze methanamine;sulfamic acid with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methanamine;sulfamic acid?
The IUPAC name of methanamine;sulfamic acid (CID 173241578) is methanamine;sulfamic acid.
What is the SMILES notation for methanamine;sulfamic acid?
The canonical SMILES for methanamine;sulfamic acid is CN.NS(=O)(=O)O.
What is the InChIKey of methanamine;sulfamic acid?
The InChIKey is GBJIYBJBUORQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5N.H3NO3S/c1-2;1-5(2,3)4/h2H2,1H3;(H3,1,2,3,4).
What are the key properties of methanamine;sulfamic acid?
methanamine;sulfamic acid has a molecular weight of 128.15 g/mol, XLogP of -1.68, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;sulfamic acid is sourced from PubChem (CID 173241578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).