(3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol

C7H10N2O — CID 143920611

IUPAC(3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol
SMILESC=C(O)/C=C\C(=C)/C=N/N
InChIInChI=1S/C7H10N2O/c1-6(5-9-8)3-4-7(2)10/h3-5,10H,1-2,8H2/b4-3-,9-5+
InChIKeyCKVVDFMEPZVWFJ-XBURUKCPSA-N
MW138.17 g/mol
LogP1.12
Rot. Bonds3

About (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol

(3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol (PubChem CID 143920611) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol.

Molecular Properties

Compound Name(3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol
PubChem CID143920611
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name(3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol
SMILESC=C(O)/C=C\C(=C)/C=N/N
InChIInChI=1S/C7H10N2O/c1-6(5-9-8)3-4-7(2)10/h3-5,10H,1-2,8H2/b4-3-,9-5+
InChIKeyCKVVDFMEPZVWFJ-XBURUKCPSA-N
XLogP1.12
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol?
The IUPAC name of (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol (CID 143920611) is (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol.
What is the SMILES notation for (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol?
The canonical SMILES for (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol is C=C(O)/C=C\C(=C)/C=N/N.
What is the InChIKey of (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol?
The InChIKey is CKVVDFMEPZVWFJ-XBURUKCPSA-N. The full InChI is InChI=1S/C7H10N2O/c1-6(5-9-8)3-4-7(2)10/h3-5,10H,1-2,8H2/b4-3-,9-5+.
What are the key properties of (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol?
(3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol has a molecular weight of 138.17 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-5-[(E)-hydrazinylidenemethyl]hexa-1,3,5-trien-2-ol is sourced from PubChem (CID 143920611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).