methanimine;triazane

CH8N4 — CID 144519373

IUPACmethanimine;triazane
SMILESNNN.[H]N=C
InChIInChI=1S/CH3N.H5N3/c1-2;1-3-2/h2H,1H2;3H,1-2H2
InChIKeyJVZYHIVWVQINRX-UHFFFAOYSA-N
MW76.10 g/mol
LogP-1.41
Rot. Bonds

About methanimine;triazane

methanimine;triazane (PubChem CID 144519373) has the molecular formula CH8N4 and a molecular weight of 76.10 g/mol. Its IUPAC name is methanimine;triazane.

Molecular Properties

Compound Namemethanimine;triazane
PubChem CID144519373
Molecular FormulaCH8N4
Molecular Weight76.10 g/mol
Exact Mass76.07
IUPAC Namemethanimine;triazane
SMILESNNN.[H]N=C
InChIInChI=1S/CH3N.H5N3/c1-2;1-3-2/h2H,1H2;3H,1-2H2
InChIKeyJVZYHIVWVQINRX-UHFFFAOYSA-N
XLogP-1.41
TPSA87.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.10
LogP ≤ 5-1.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

triazane;hydrate
CID 162025964
thiohydroxylamine;triazane
CID 161303654
methanimine;silver
CID 87133687
methanimine;dihydrochloride
CID 172678278
methanimine;hydrochloride
CID 172805280
dihydrazinylphosphinimylhydrazine
CID 71361441
N-aminoselenohydroxylamine
CID 173012389
fluorohydrazine
CID 21071432
phosphanylhydrazine
CID 20681621
azane;methanimine;platinum(2+);dichloride
CID 15948930
N'-(2-aminoethyl)ethane-1,2-diamine;tris(ethane-1,2-diamine);ethenimine
CID 173211804
ethane;ethenylhydrazine
CID 170974612

Frequently Asked Questions

What is the IUPAC name of methanimine;triazane?
The IUPAC name of methanimine;triazane (CID 144519373) is methanimine;triazane.
What is the SMILES notation for methanimine;triazane?
The canonical SMILES for methanimine;triazane is NNN.[H]N=C.
What is the InChIKey of methanimine;triazane?
The InChIKey is JVZYHIVWVQINRX-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3N.H5N3/c1-2;1-3-2/h2H,1H2;3H,1-2H2.
What are the key properties of methanimine;triazane?
methanimine;triazane has a molecular weight of 76.10 g/mol, XLogP of -1.41, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanimine;triazane is sourced from PubChem (CID 144519373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).