methane;methanediimine

C2H6N2 — CID 157346363

IUPACmethane;methanediimine
SMILESC.N=C=N
InChIInChI=1S/CH2N2.CH4/c2-1-3;/h2-3H;1H4
InChIKeyNGBMWODZSRMVJR-UHFFFAOYSA-N
MW58.08 g/mol
LogP0.95
Rot. Bonds

About methane;methanediimine

methane;methanediimine (PubChem CID 157346363) has the molecular formula C2H6N2 and a molecular weight of 58.08 g/mol. Its IUPAC name is methane;methanediimine.

Molecular Properties

Compound Namemethane;methanediimine
PubChem CID157346363
Molecular FormulaC2H6N2
Molecular Weight58.08 g/mol
Exact Mass58.05
IUPAC Namemethane;methanediimine
SMILESC.N=C=N
InChIInChI=1S/CH2N2.CH4/c2-1-3;/h2-3H;1H4
InChIKeyNGBMWODZSRMVJR-UHFFFAOYSA-N
XLogP0.95
TPSA47.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50058.08
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methane;methanediimine?
The IUPAC name of methane;methanediimine (CID 157346363) is methane;methanediimine.
What is the SMILES notation for methane;methanediimine?
The canonical SMILES for methane;methanediimine is C.N=C=N.
What is the InChIKey of methane;methanediimine?
The InChIKey is NGBMWODZSRMVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2N2.CH4/c2-1-3;/h2-3H;1H4.
What are the key properties of methane;methanediimine?
methane;methanediimine has a molecular weight of 58.08 g/mol, XLogP of 0.95, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;methanediimine is sourced from PubChem (CID 157346363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).