(1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane

C4H12N4 — CID 172975976

IUPAC(1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane
SMILESCC/C=N/NNNC
InChIInChI=1S/C4H12N4/c1-3-4-6-8-7-5-2/h4-5,7-8H,3H2,1-2H3/b6-4+
InChIKeyDJGFYELSVQVRAF-GQCTYLIASA-N
MW116.17 g/mol
LogP-0.39
Rot. Bonds4

About (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane

(1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane (PubChem CID 172975976) has the molecular formula C4H12N4 and a molecular weight of 116.17 g/mol. Its IUPAC name is (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane.

Molecular Properties

Compound Name(1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane
PubChem CID172975976
Molecular FormulaC4H12N4
Molecular Weight116.17 g/mol
Exact Mass116.11
IUPAC Name(1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane
SMILESCC/C=N/NNNC
InChIInChI=1S/C4H12N4/c1-3-4-6-8-7-5-2/h4-5,7-8H,3H2,1-2H3/b6-4+
InChIKeyDJGFYELSVQVRAF-GQCTYLIASA-N
XLogP-0.39
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.17
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane?
The IUPAC name of (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane (CID 172975976) is (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane.
What is the SMILES notation for (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane?
The canonical SMILES for (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane is CC/C=N/NNNC.
What is the InChIKey of (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane?
The InChIKey is DJGFYELSVQVRAF-GQCTYLIASA-N. The full InChI is InChI=1S/C4H12N4/c1-3-4-6-8-7-5-2/h4-5,7-8H,3H2,1-2H3/b6-4+.
What are the key properties of (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane?
(1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane has a molecular weight of 116.17 g/mol, XLogP of -0.39, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-[(2-methylhydrazinyl)hydrazinylidene]propane is sourced from PubChem (CID 172975976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).