methanediimine;sulfur monoxide

CH2N2OS — CID 173434188

IUPACmethanediimine;sulfur monoxide
SMILESN=C=N.O=S
InChIInChI=1S/CH2N2.OS/c2-1-3;1-2/h2-3H;
InChIKeyCOYYFWJXANNZKZ-UHFFFAOYSA-N
MW90.11 g/mol
LogP-0.02
Rot. Bonds

About methanediimine;sulfur monoxide

methanediimine;sulfur monoxide (PubChem CID 173434188) has the molecular formula CH2N2OS and a molecular weight of 90.11 g/mol. Its IUPAC name is methanediimine;sulfur monoxide.

Molecular Properties

Compound Namemethanediimine;sulfur monoxide
PubChem CID173434188
Molecular FormulaCH2N2OS
Molecular Weight90.11 g/mol
Exact Mass89.99
IUPAC Namemethanediimine;sulfur monoxide
SMILESN=C=N.O=S
InChIInChI=1S/CH2N2.OS/c2-1-3;1-2/h2-3H;
InChIKeyCOYYFWJXANNZKZ-UHFFFAOYSA-N
XLogP-0.02
TPSA64.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.11
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

methanediimine
CID 161145332
methanediimine;zirconium
CID 175955107
methanediimine;oxaldehyde
CID 175329130
potassium;methanediimine;hydroxide
CID 174948340
aluminum;methanediimine;triiodide
CID 174884047
isocyanic acid;trihydrochloride
CID 172863898
isocyanic acid;lanthanum
CID 160896504
CID 87228309
CID 87228309
isocyanic acid;hydrate
CID 19755102
isocyanic acid;hydrofluoride
CID 175035145
isocyanic acid;hydroiodide
CID 88505610
isothiocyanic acid;methane
CID 173005239

Frequently Asked Questions

What is the IUPAC name of methanediimine;sulfur monoxide?
The IUPAC name of methanediimine;sulfur monoxide (CID 173434188) is methanediimine;sulfur monoxide.
What is the SMILES notation for methanediimine;sulfur monoxide?
The canonical SMILES for methanediimine;sulfur monoxide is N=C=N.O=S.
What is the InChIKey of methanediimine;sulfur monoxide?
The InChIKey is COYYFWJXANNZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2N2.OS/c2-1-3;1-2/h2-3H;.
What are the key properties of methanediimine;sulfur monoxide?
methanediimine;sulfur monoxide has a molecular weight of 90.11 g/mol, XLogP of -0.02, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanediimine;sulfur monoxide is sourced from PubChem (CID 173434188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).