CID 150649855

H5N3O2S — CID 150649855

IUPAC—
SMILESNNOS(N)=O
InChIInChI=1S/H5N3O2S/c1-3-5-6(2)4/h3H,1-2H2
InChIKeyHIVHTRBNEUIZMC-UHFFFAOYSA-N
MW111.13 g/mol
LogP-2.08
Rot. Bonds2

About CID 150649855

CID 150649855 (PubChem CID 150649855) has the molecular formula H5N3O2S and a molecular weight of 111.13 g/mol.

Molecular Properties

Compound NameCID 150649855
PubChem CID150649855
Molecular FormulaH5N3O2S
Molecular Weight111.13 g/mol
Exact Mass111.01
IUPAC Name—
SMILESNNOS(N)=O
InChIInChI=1S/H5N3O2S/c1-3-5-6(2)4/h3H,1-2H2
InChIKeyHIVHTRBNEUIZMC-UHFFFAOYSA-N
XLogP-2.08
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.13
LogP ≤ 5-2.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dihydrazinyl sulfite
CID 173066354
CID 20686844
CID 20686844
sulfinamoyl hydrogen sulfite
CID 174417380
N-aminohydroxylamine;sulfurous acid
CID 175603223
CID 59389736
CID 59389736
hydrazinyl hypofluorite
CID 142717210
1-chloroethanesulfinamide
CID 154126260
methyl N-sulfinooxycarbamate
CID 57298047
CID 174767680
CID 174767680
methoxyhydrazine;hydrochloride
CID 158874781
methoxyhydrazine;hydrate
CID 174488979
(methylcarbamoylamino) methanesulfinate
CID 20717006

Frequently Asked Questions

What is the IUPAC name of CID 150649855?
The IUPAC name of CID 150649855 (CID 150649855) is not available.
What is the SMILES notation for CID 150649855?
The canonical SMILES for CID 150649855 is NNOS(N)=O.
What is the InChIKey of CID 150649855?
The InChIKey is HIVHTRBNEUIZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/H5N3O2S/c1-3-5-6(2)4/h3H,1-2H2.
What are the key properties of CID 150649855?
CID 150649855 has a molecular weight of 111.13 g/mol, XLogP of -2.08, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 150649855 is sourced from PubChem (CID 150649855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).