(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine

C13H23N3 — CID 139539344

IUPAC(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine
SMILESC=N/N=C\CC(C)NC(=C)C1CCCCC1
InChIInChI=1S/C13H23N3/c1-11(9-10-15-14-3)16-12(2)13-7-5-4-6-8-13/h10-11,13,16H,2-9H2,1H3/b15-10-
InChIKeyFUEMNIQBURYZPA-GDNBJRDFSA-N
MW221.35 g/mol
LogP3.13
Rot. Bonds6

About (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine

(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine (PubChem CID 139539344) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine.

Molecular Properties

Compound Name(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine
PubChem CID139539344
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine
SMILESC=N/N=C\CC(C)NC(=C)C1CCCCC1
InChIInChI=1S/C13H23N3/c1-11(9-10-15-14-3)16-12(2)13-7-5-4-6-8-13/h10-11,13,16H,2-9H2,1H3/b15-10-
InChIKeyFUEMNIQBURYZPA-GDNBJRDFSA-N
XLogP3.13
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine 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 (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine?
The IUPAC name of (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine (CID 139539344) is (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine.
What is the SMILES notation for (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine?
The canonical SMILES for (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine is C=N/N=C\CC(C)NC(=C)C1CCCCC1.
What is the InChIKey of (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine?
The InChIKey is FUEMNIQBURYZPA-GDNBJRDFSA-N. The full InChI is InChI=1S/C13H23N3/c1-11(9-10-15-14-3)16-12(2)13-7-5-4-6-8-13/h10-11,13,16H,2-9H2,1H3/b15-10-.
What are the key properties of (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine?
(4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-N-(1-cyclohexylethenyl)-4-(methylidenehydrazinylidene)butan-2-amine is sourced from PubChem (CID 139539344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).