azane;sulfamic acid;sulfamide

H13N5O8S3 — CID 174286592

IUPACazane;sulfamic acid;sulfamide
SMILESN.NS(=O)(=O)O.NS(=O)(=O)O.NS(N)(=O)=O
InChIInChI=1S/H4N2O2S.2H3NO3S.H3N/c3*1-5(2,3)4;/h(H4,1,2,3,4);2*(H3,1,2,3,4);1H3
InChIKeyHQCQLVHHVFVHLK-UHFFFAOYSA-N
MW307.33 g/mol
LogP-4.19
Rot. Bonds

About azane;sulfamic acid;sulfamide

azane;sulfamic acid;sulfamide (PubChem CID 174286592) has the molecular formula H13N5O8S3 and a molecular weight of 307.33 g/mol. Its IUPAC name is azane;sulfamic acid;sulfamide.

Molecular Properties

Compound Nameazane;sulfamic acid;sulfamide
PubChem CID174286592
Molecular FormulaH13N5O8S3
Molecular Weight307.33 g/mol
Exact Mass306.99
IUPAC Nameazane;sulfamic acid;sulfamide
SMILESN.NS(=O)(=O)O.NS(=O)(=O)O.NS(N)(=O)=O
InChIInChI=1S/H4N2O2S.2H3NO3S.H3N/c3*1-5(2,3)4;/h(H4,1,2,3,4);2*(H3,1,2,3,4);1H3
InChIKeyHQCQLVHHVFVHLK-UHFFFAOYSA-N
XLogP-4.19
TPSA281.96 Ų
H-Bond Donors7
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.33
LogP ≤ 5-4.19
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

azane;sulfamic acid
CID 172811731
sulfamic acid;yttrium
CID 159754211
methane;sulfamic acid
CID 87277660
CID 131847531
CID 131847531
ethane;sulfamic acid
CID 172846940
nickel;sulfamic acid;sulfuric acid
CID 173415674
hydroxylamine;sulfamide
CID 174520411
calcium;magnesium;hydride;sulfamic acid
CID 175059340
strontium;hydride;sulfamic acid;hydrate
CID 175447547
sulfamic acid;sulfurous acid
CID 159581131
bis(nickel(2+));sulfamic acid;disulfate
CID 157251351
sulfamide;hydrofluoride
CID 159368597

Frequently Asked Questions

What is the IUPAC name of azane;sulfamic acid;sulfamide?
The IUPAC name of azane;sulfamic acid;sulfamide (CID 174286592) is azane;sulfamic acid;sulfamide.
What is the SMILES notation for azane;sulfamic acid;sulfamide?
The canonical SMILES for azane;sulfamic acid;sulfamide is N.NS(=O)(=O)O.NS(=O)(=O)O.NS(N)(=O)=O.
What is the InChIKey of azane;sulfamic acid;sulfamide?
The InChIKey is HQCQLVHHVFVHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/H4N2O2S.2H3NO3S.H3N/c3*1-5(2,3)4;/h(H4,1,2,3,4);2*(H3,1,2,3,4);1H3.
What are the key properties of azane;sulfamic acid;sulfamide?
azane;sulfamic acid;sulfamide has a molecular weight of 307.33 g/mol, XLogP of -4.19, 0 rotatable bonds, 7 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for azane;sulfamic acid;sulfamide is sourced from PubChem (CID 174286592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).