(E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine

C8H16N6 — CID 5466320

IUPAC(E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine
SMILESCC(=N\N)/C(C)=N/N=C(C)/C(C)=N/N
InChIInChI=1S/C8H16N6/c1-5(11-9)7(3)13-14-8(4)6(2)12-10/h9-10H2,1-4H3/b11-5+,12-6+,13-7+,14-8+
InChIKeyHHYHTXIRMGYIGZ-JRXATRHQSA-N
MW196.26 g/mol
LogP0.49
Rot. Bonds3

About (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine

(E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine (PubChem CID 5466320) has the molecular formula C8H16N6 and a molecular weight of 196.26 g/mol. Its IUPAC name is (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine.

Molecular Properties

Compound Name(E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine
PubChem CID5466320
Molecular FormulaC8H16N6
Molecular Weight196.26 g/mol
Exact Mass196.14
IUPAC Name(E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine
SMILESCC(=N\N)/C(C)=N/N=C(C)/C(C)=N/N
InChIInChI=1S/C8H16N6/c1-5(11-9)7(3)13-14-8(4)6(2)12-10/h9-10H2,1-4H3/b11-5+,12-6+,13-7+,14-8+
InChIKeyHHYHTXIRMGYIGZ-JRXATRHQSA-N
XLogP0.49
TPSA101.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.26
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'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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Frequently Asked Questions

What is the IUPAC name of (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine?
The IUPAC name of (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine (CID 5466320) is (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine.
What is the SMILES notation for (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine?
The canonical SMILES for (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine is CC(=N\N)/C(C)=N/N=C(C)/C(C)=N/N.
What is the InChIKey of (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine?
The InChIKey is HHYHTXIRMGYIGZ-JRXATRHQSA-N. The full InChI is InChI=1S/C8H16N6/c1-5(11-9)7(3)13-14-8(4)6(2)12-10/h9-10H2,1-4H3/b11-5+,12-6+,13-7+,14-8+.
What are the key properties of (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine?
(E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine has a molecular weight of 196.26 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (E,3E)-3-hydrazinylidene-N-[(E)-[(3E)-3-hydrazinylidenebutan-2-ylidene]amino]butan-2-imine is sourced from PubChem (CID 5466320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).