CID 18407106

H4N2O2S — CID 18407106

IUPAC—
SMILESNNS(=O)O
InChIInChI=1S/H4N2O2S/c1-2-5(3)4/h2H,1H2,(H,3,4)
InChIKeyMPDGHNNPLVGRFC-UHFFFAOYSA-N
MW96.11 g/mol
LogP-1.41
Rot. Bonds1

About CID 18407106

CID 18407106 (PubChem CID 18407106) has the molecular formula H4N2O2S and a molecular weight of 96.11 g/mol.

Molecular Properties

Compound NameCID 18407106
PubChem CID18407106
Molecular FormulaH4N2O2S
Molecular Weight96.11 g/mol
Exact Mass96.00
IUPAC Name—
SMILESNNS(=O)O
InChIInChI=1S/H4N2O2S/c1-2-5(3)4/h2H,1H2,(H,3,4)
InChIKeyMPDGHNNPLVGRFC-UHFFFAOYSA-N
XLogP-1.41
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.11
LogP ≤ 5-1.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 18407106?
The IUPAC name of CID 18407106 (CID 18407106) is not available.
What is the SMILES notation for CID 18407106?
The canonical SMILES for CID 18407106 is NNS(=O)O.
What is the InChIKey of CID 18407106?
The InChIKey is MPDGHNNPLVGRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/H4N2O2S/c1-2-5(3)4/h2H,1H2,(H,3,4).
What are the key properties of CID 18407106?
CID 18407106 has a molecular weight of 96.11 g/mol, XLogP of -1.41, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18407106 is sourced from PubChem (CID 18407106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).