N-[(2Z)-octa-2,7-dienyl]cyclohexanamine

C14H25N — CID 134994037

IUPACN-[(2Z)-octa-2,7-dienyl]cyclohexanamine
SMILESC=CCCC/C=C\CNC1CCCCC1
InChIInChI=1S/C14H25N/c1-2-3-4-5-6-10-13-15-14-11-8-7-9-12-14/h2,6,10,14-15H,1,3-5,7-9,11-13H2/b10-6-
InChIKeyJSCYIRLHXFQTSD-POHAHGRESA-N
MW207.36 g/mol
LogP3.82
Rot. Bonds7

About N-[(2Z)-octa-2,7-dienyl]cyclohexanamine

N-[(2Z)-octa-2,7-dienyl]cyclohexanamine (PubChem CID 134994037) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N-[(2Z)-octa-2,7-dienyl]cyclohexanamine.

Molecular Properties

Compound NameN-[(2Z)-octa-2,7-dienyl]cyclohexanamine
PubChem CID134994037
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN-[(2Z)-octa-2,7-dienyl]cyclohexanamine
SMILESC=CCCC/C=C\CNC1CCCCC1
InChIInChI=1S/C14H25N/c1-2-3-4-5-6-10-13-15-14-11-8-7-9-12-14/h2,6,10,14-15H,1,3-5,7-9,11-13H2/b10-6-
InChIKeyJSCYIRLHXFQTSD-POHAHGRESA-N
XLogP3.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-[(2Z)-octa-2,7-dienyl]cyclohexanamine 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 N-[(2Z)-octa-2,7-dienyl]cyclohexanamine?
The IUPAC name of N-[(2Z)-octa-2,7-dienyl]cyclohexanamine (CID 134994037) is N-[(2Z)-octa-2,7-dienyl]cyclohexanamine.
What is the SMILES notation for N-[(2Z)-octa-2,7-dienyl]cyclohexanamine?
The canonical SMILES for N-[(2Z)-octa-2,7-dienyl]cyclohexanamine is C=CCCC/C=C\CNC1CCCCC1.
What is the InChIKey of N-[(2Z)-octa-2,7-dienyl]cyclohexanamine?
The InChIKey is JSCYIRLHXFQTSD-POHAHGRESA-N. The full InChI is InChI=1S/C14H25N/c1-2-3-4-5-6-10-13-15-14-11-8-7-9-12-14/h2,6,10,14-15H,1,3-5,7-9,11-13H2/b10-6-.
What are the key properties of N-[(2Z)-octa-2,7-dienyl]cyclohexanamine?
N-[(2Z)-octa-2,7-dienyl]cyclohexanamine has a molecular weight of 207.36 g/mol, XLogP of 3.82, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2Z)-octa-2,7-dienyl]cyclohexanamine is sourced from PubChem (CID 134994037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).