(6Z)-6-(octylhydrazinylidene)heptan-1-ol

C15H32N2O — CID 6393234

IUPAC(6Z)-6-(octylhydrazinylidene)heptan-1-ol
SMILESCCCCCCCCN/N=C(/C)CCCCCO
InChIInChI=1S/C15H32N2O/c1-3-4-5-6-7-10-13-16-17-15(2)12-9-8-11-14-18/h16,18H,3-14H2,1-2H3/b17-15-
InChIKeyWROXKNBGOAXNPO-ICFOKQHNSA-N
MW256.43 g/mol
LogP3.87
Rot. Bonds13

About (6Z)-6-(octylhydrazinylidene)heptan-1-ol

(6Z)-6-(octylhydrazinylidene)heptan-1-ol (PubChem CID 6393234) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is (6Z)-6-(octylhydrazinylidene)heptan-1-ol.

Molecular Properties

Compound Name(6Z)-6-(octylhydrazinylidene)heptan-1-ol
PubChem CID6393234
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name(6Z)-6-(octylhydrazinylidene)heptan-1-ol
SMILESCCCCCCCCN/N=C(/C)CCCCCO
InChIInChI=1S/C15H32N2O/c1-3-4-5-6-7-10-13-16-17-15(2)12-9-8-11-14-18/h16,18H,3-14H2,1-2H3/b17-15-
InChIKeyWROXKNBGOAXNPO-ICFOKQHNSA-N
XLogP3.87
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 (6Z)-6-(octylhydrazinylidene)heptan-1-ol?
The IUPAC name of (6Z)-6-(octylhydrazinylidene)heptan-1-ol (CID 6393234) is (6Z)-6-(octylhydrazinylidene)heptan-1-ol.
What is the SMILES notation for (6Z)-6-(octylhydrazinylidene)heptan-1-ol?
The canonical SMILES for (6Z)-6-(octylhydrazinylidene)heptan-1-ol is CCCCCCCCN/N=C(/C)CCCCCO.
What is the InChIKey of (6Z)-6-(octylhydrazinylidene)heptan-1-ol?
The InChIKey is WROXKNBGOAXNPO-ICFOKQHNSA-N. The full InChI is InChI=1S/C15H32N2O/c1-3-4-5-6-7-10-13-16-17-15(2)12-9-8-11-14-18/h16,18H,3-14H2,1-2H3/b17-15-.
What are the key properties of (6Z)-6-(octylhydrazinylidene)heptan-1-ol?
(6Z)-6-(octylhydrazinylidene)heptan-1-ol has a molecular weight of 256.43 g/mol, XLogP of 3.87, 13 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-(octylhydrazinylidene)heptan-1-ol is sourced from PubChem (CID 6393234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).