2-(methylhydrazinylidene)propanedinitrile

C4H4N4 — CID 20644325

IUPAC2-(methylhydrazinylidene)propanedinitrile
SMILESCNN=C(C#N)C#N
InChIInChI=1S/C4H4N4/c1-7-8-4(2-5)3-6/h7H,1H3
InChIKeyOHAZXIMDCZAWRR-UHFFFAOYSA-N
MW108.10 g/mol
LogP-0.39
Rot. Bonds1

About 2-(methylhydrazinylidene)propanedinitrile

2-(methylhydrazinylidene)propanedinitrile (PubChem CID 20644325) has the molecular formula C4H4N4 and a molecular weight of 108.10 g/mol. Its IUPAC name is 2-(methylhydrazinylidene)propanedinitrile.

Molecular Properties

Compound Name2-(methylhydrazinylidene)propanedinitrile
PubChem CID20644325
Molecular FormulaC4H4N4
Molecular Weight108.10 g/mol
Exact Mass108.04
IUPAC Name2-(methylhydrazinylidene)propanedinitrile
SMILESCNN=C(C#N)C#N
InChIInChI=1S/C4H4N4/c1-7-8-4(2-5)3-6/h7H,1H3
InChIKeyOHAZXIMDCZAWRR-UHFFFAOYSA-N
XLogP-0.39
TPSA71.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.10
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(pentylhydrazinylidene)propanedinitrile
CID 87178264
N-[3-(methylhydrazinylidene)butan-2-ylideneamino]methanamine
CID 6850505
2-[(2,6-difluoro-4-methylphenyl)hydrazinylidene]propanedinitrile
CID 169339068
2-[(4-ethylphenyl)hydrazinylidene]propanedinitrile
CID 169341976
2-[(3,4-difluoro-5-methoxyphenyl)hydrazinylidene]propanedinitrile
CID 169341897
dicyanomethylidenecyanamide
CID 14040994
disodium;ethene-1,1,2,2-tetracarbonitrile;hydride
CID 173357424
2-[(4-fluorophenyl)hydrazinylidene]propanedinitrile
CID 832904
2-cyano-3-(ethylamino)-N',3-bis(methylamino)prop-2-enimidamide
CID 174021445
2-[(2-fluoro-6-methylphenyl)hydrazinylidene]propanedinitrile
CID 169337369
2-[(3-methyl-1H-indol-7-yl)hydrazinylidene]propanedinitrile
CID 169337941
2-[(4,5-dimethoxy-2-methylphenyl)hydrazinylidene]propanedinitrile
CID 169338095

Frequently Asked Questions

What is the IUPAC name of 2-(methylhydrazinylidene)propanedinitrile?
The IUPAC name of 2-(methylhydrazinylidene)propanedinitrile (CID 20644325) is 2-(methylhydrazinylidene)propanedinitrile.
What is the SMILES notation for 2-(methylhydrazinylidene)propanedinitrile?
The canonical SMILES for 2-(methylhydrazinylidene)propanedinitrile is CNN=C(C#N)C#N.
What is the InChIKey of 2-(methylhydrazinylidene)propanedinitrile?
The InChIKey is OHAZXIMDCZAWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N4/c1-7-8-4(2-5)3-6/h7H,1H3.
What are the key properties of 2-(methylhydrazinylidene)propanedinitrile?
2-(methylhydrazinylidene)propanedinitrile has a molecular weight of 108.10 g/mol, XLogP of -0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylhydrazinylidene)propanedinitrile is sourced from PubChem (CID 20644325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).