(Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine

C7H11N3 — CID 145103734

IUPAC(Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine
SMILESC=C/N=C(/C=C\C)\C=N\N
InChIInChI=1S/C7H11N3/c1-3-5-7(6-10-8)9-4-2/h3-6H,2,8H2,1H3/b5-3-,9-7-,10-6+
InChIKeyXJYSIVPFMFQDOK-QVFMRCLASA-N
MW137.19 g/mol
LogP1.09
Rot. Bonds3

About (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine

(Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine (PubChem CID 145103734) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine.

Molecular Properties

Compound Name(Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine
PubChem CID145103734
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name(Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine
SMILESC=C/N=C(/C=C\C)\C=N\N
InChIInChI=1S/C7H11N3/c1-3-5-7(6-10-8)9-4-2/h3-6H,2,8H2,1H3/b5-3-,9-7-,10-6+
InChIKeyXJYSIVPFMFQDOK-QVFMRCLASA-N
XLogP1.09
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine?
The IUPAC name of (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine (CID 145103734) is (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine.
What is the SMILES notation for (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine?
The canonical SMILES for (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine is C=C/N=C(/C=C\C)\C=N\N.
What is the InChIKey of (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine?
The InChIKey is XJYSIVPFMFQDOK-QVFMRCLASA-N. The full InChI is InChI=1S/C7H11N3/c1-3-5-7(6-10-8)9-4-2/h3-6H,2,8H2,1H3/b5-3-,9-7-,10-6+.
What are the key properties of (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine?
(Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine has a molecular weight of 137.19 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,1E)-N-ethenyl-1-hydrazinylidenepent-3-en-2-imine is sourced from PubChem (CID 145103734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).