N-cyclohexyl-6-methylhept-5-en-2-imine

C14H25N — CID 11009116

IUPACN-cyclohexyl-6-methylhept-5-en-2-imine
SMILESCC(C)=CCC/C(C)=N/C1CCCCC1
InChIInChI=1S/C14H25N/c1-12(2)8-7-9-13(3)15-14-10-5-4-6-11-14/h8,14H,4-7,9-11H2,1-3H3/b15-13+
InChIKeyZBYKRPLFTJVUQM-FYWRMAATSA-N
MW207.36 g/mol
LogP4.53
Rot. Bonds4

About N-cyclohexyl-6-methylhept-5-en-2-imine

N-cyclohexyl-6-methylhept-5-en-2-imine (PubChem CID 11009116) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N-cyclohexyl-6-methylhept-5-en-2-imine.

Molecular Properties

Compound NameN-cyclohexyl-6-methylhept-5-en-2-imine
PubChem CID11009116
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN-cyclohexyl-6-methylhept-5-en-2-imine
SMILESCC(C)=CCC/C(C)=N/C1CCCCC1
InChIInChI=1S/C14H25N/c1-12(2)8-7-9-13(3)15-14-10-5-4-6-11-14/h8,14H,4-7,9-11H2,1-3H3/b15-13+
InChIKeyZBYKRPLFTJVUQM-FYWRMAATSA-N
XLogP4.53
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-methylhept-5-en-2-imine?
The IUPAC name of N-cyclohexyl-6-methylhept-5-en-2-imine (CID 11009116) is N-cyclohexyl-6-methylhept-5-en-2-imine.
What is the SMILES notation for N-cyclohexyl-6-methylhept-5-en-2-imine?
The canonical SMILES for N-cyclohexyl-6-methylhept-5-en-2-imine is CC(C)=CCC/C(C)=N/C1CCCCC1.
What is the InChIKey of N-cyclohexyl-6-methylhept-5-en-2-imine?
The InChIKey is ZBYKRPLFTJVUQM-FYWRMAATSA-N. The full InChI is InChI=1S/C14H25N/c1-12(2)8-7-9-13(3)15-14-10-5-4-6-11-14/h8,14H,4-7,9-11H2,1-3H3/b15-13+.
What are the key properties of N-cyclohexyl-6-methylhept-5-en-2-imine?
N-cyclohexyl-6-methylhept-5-en-2-imine has a molecular weight of 207.36 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-methylhept-5-en-2-imine is sourced from PubChem (CID 11009116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).