1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine

C16H28N2 — CID 177273621

IUPAC1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine
SMILESC=CC1CCC(/C=N/CCCCCCN=C)CC1
InChIInChI=1S/C16H28N2/c1-3-15-8-10-16(11-9-15)14-18-13-7-5-4-6-12-17-2/h3,14-16H,1-2,4-13H2/b18-14+
InChIKeyWPQSCHDXROIIOR-NBVRZTHBSA-N
MW248.41 g/mol
LogP4.31
Rot. Bonds9

About 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine

1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine (PubChem CID 177273621) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine.

Molecular Properties

Compound Name1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine
PubChem CID177273621
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC Name1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine
SMILESC=CC1CCC(/C=N/CCCCCCN=C)CC1
InChIInChI=1S/C16H28N2/c1-3-15-8-10-16(11-9-15)14-18-13-7-5-4-6-12-17-2/h3,14-16H,1-2,4-13H2/b18-14+
InChIKeyWPQSCHDXROIIOR-NBVRZTHBSA-N
XLogP4.31
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-2-(4-ethenylcyclohexyl)ethanimine
CID 68430727
N-[[4-[(pent-1-en-3-ylideneamino)methyl]cyclohexyl]methyl]pent-1-en-3-imine
CID 87313301
3-prop-2-enyl-N-[5-(3-prop-2-enyloctylideneamino)pentyl]octan-1-imine
CID 88610262
N-butyl-5-ethenyloct-7-en-1-imine
CID 89392711
N-ethyl-3-(thionitrosomethyl)oct-7-en-1-imine
CID 123715391
1-(4-ethenylcyclohexyl)-N-[(4-ethenylcyclohexyl)methylideneamino]methanimine
CID 145841154
1-(4-ethenylcyclohexyl)-N-methylmethanimine
CID 148081938
3-Prop-2-enyl-2,3,4,5-tetrahydropyridine
CID 173283580

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine?
The IUPAC name of 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine (CID 177273621) is 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine.
What is the SMILES notation for 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine?
The canonical SMILES for 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine is C=CC1CCC(/C=N/CCCCCCN=C)CC1.
What is the InChIKey of 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine?
The InChIKey is WPQSCHDXROIIOR-NBVRZTHBSA-N. The full InChI is InChI=1S/C16H28N2/c1-3-15-8-10-16(11-9-15)14-18-13-7-5-4-6-12-17-2/h3,14-16H,1-2,4-13H2/b18-14+.
What are the key properties of 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine?
1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine has a molecular weight of 248.41 g/mol, XLogP of 4.31, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethenylcyclohexyl)-N-[6-(methylideneamino)hexyl]methanimine is sourced from PubChem (CID 177273621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).