N-cyclohexyl-2-ethylhept-2-en-1-imine

C15H27N — CID 74047303

IUPACN-cyclohexyl-2-ethylhept-2-en-1-imine
SMILESCCCCC=C(/C=N/C1CCCCC1)CC
InChIInChI=1S/C15H27N/c1-3-5-7-10-14(4-2)13-16-15-11-8-6-9-12-15/h10,13,15H,3-9,11-12H2,1-2H3/b14-10?,16-13+
InChIKeyMXLDZADAXHHKRC-JXPWQSFDSA-N
MW221.39 g/mol
LogP4.92
Rot. Bonds6

About N-cyclohexyl-2-ethylhept-2-en-1-imine

N-cyclohexyl-2-ethylhept-2-en-1-imine (PubChem CID 74047303) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is N-cyclohexyl-2-ethylhept-2-en-1-imine.

Molecular Properties

Compound NameN-cyclohexyl-2-ethylhept-2-en-1-imine
PubChem CID74047303
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC NameN-cyclohexyl-2-ethylhept-2-en-1-imine
SMILESCCCCC=C(/C=N/C1CCCCC1)CC
InChIInChI=1S/C15H27N/c1-3-5-7-10-14(4-2)13-16-15-11-8-6-9-12-15/h10,13,15H,3-9,11-12H2,1-2H3/b14-10?,16-13+
InChIKeyMXLDZADAXHHKRC-JXPWQSFDSA-N
XLogP4.92
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(E)-N-cyclohexyl-2-ethylbut-2-en-1-imine
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copper(1+);N-cyclohexyl-1-phenylmethanimine
CID 135046006
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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-ethylhept-2-en-1-imine?
The IUPAC name of N-cyclohexyl-2-ethylhept-2-en-1-imine (CID 74047303) is N-cyclohexyl-2-ethylhept-2-en-1-imine.
What is the SMILES notation for N-cyclohexyl-2-ethylhept-2-en-1-imine?
The canonical SMILES for N-cyclohexyl-2-ethylhept-2-en-1-imine is CCCCC=C(/C=N/C1CCCCC1)CC.
What is the InChIKey of N-cyclohexyl-2-ethylhept-2-en-1-imine?
The InChIKey is MXLDZADAXHHKRC-JXPWQSFDSA-N. The full InChI is InChI=1S/C15H27N/c1-3-5-7-10-14(4-2)13-16-15-11-8-6-9-12-15/h10,13,15H,3-9,11-12H2,1-2H3/b14-10?,16-13+.
What are the key properties of N-cyclohexyl-2-ethylhept-2-en-1-imine?
N-cyclohexyl-2-ethylhept-2-en-1-imine has a molecular weight of 221.39 g/mol, XLogP of 4.92, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-ethylhept-2-en-1-imine is sourced from PubChem (CID 74047303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).