(Z)-4-ethenyl-6-methyliminohex-4-en-1-ol

C9H15NO — CID 89322596

IUPAC(Z)-4-ethenyl-6-methyliminohex-4-en-1-ol
SMILESC=C/C(=C\C=N\C)CCCO
InChIInChI=1S/C9H15NO/c1-3-9(5-4-8-11)6-7-10-2/h3,6-7,11H,1,4-5,8H2,2H3/b9-6+,10-7+
InChIKeyNFJBZVHBXMDRGX-KZZDLZNXSA-N
MW153.22 g/mol
LogP1.57
Rot. Bonds5

About (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol

(Z)-4-ethenyl-6-methyliminohex-4-en-1-ol (PubChem CID 89322596) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol.

Molecular Properties

Compound Name(Z)-4-ethenyl-6-methyliminohex-4-en-1-ol
PubChem CID89322596
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(Z)-4-ethenyl-6-methyliminohex-4-en-1-ol
SMILESC=C/C(=C\C=N\C)CCCO
InChIInChI=1S/C9H15NO/c1-3-9(5-4-8-11)6-7-10-2/h3,6-7,11H,1,4-5,8H2,2H3/b9-6+,10-7+
InChIKeyNFJBZVHBXMDRGX-KZZDLZNXSA-N
XLogP1.57
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol?
The IUPAC name of (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol (CID 89322596) is (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol.
What is the SMILES notation for (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol?
The canonical SMILES for (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol is C=C/C(=C\C=N\C)CCCO.
What is the InChIKey of (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol?
The InChIKey is NFJBZVHBXMDRGX-KZZDLZNXSA-N. The full InChI is InChI=1S/C9H15NO/c1-3-9(5-4-8-11)6-7-10-2/h3,6-7,11H,1,4-5,8H2,2H3/b9-6+,10-7+.
What are the key properties of (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol?
(Z)-4-ethenyl-6-methyliminohex-4-en-1-ol has a molecular weight of 153.22 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-ethenyl-6-methyliminohex-4-en-1-ol is sourced from PubChem (CID 89322596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).