(2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide

C15H23NO — CID 21160446

IUPAC(2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide
SMILESCC1=CCCC/C1=C\C=[N+](\[O-])C1CCCCC1
InChIInChI=1S/C15H23NO/c1-13-7-5-6-8-14(13)11-12-16(17)15-9-3-2-4-10-15/h7,11-12,15H,2-6,8-10H2,1H3/b14-11+,16-12+
InChIKeyUQDWBNLJVDYGNM-MHMBTURYSA-N
MW233.35 g/mol
LogP3.96
Rot. Bonds2

About (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide

(2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide (PubChem CID 21160446) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide.

Molecular Properties

Compound Name(2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide
PubChem CID21160446
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name(2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide
SMILESCC1=CCCC/C1=C\C=[N+](\[O-])C1CCCCC1
InChIInChI=1S/C15H23NO/c1-13-7-5-6-8-14(13)11-12-16(17)15-9-3-2-4-10-15/h7,11-12,15H,2-6,8-10H2,1H3/b14-11+,16-12+
InChIKeyUQDWBNLJVDYGNM-MHMBTURYSA-N
XLogP3.96
TPSA26.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-4-methylpent-3-en-2-imine oxide
CID 134998216
(E)-3-(cyclohexen-1-yl)-N-cyclohexylprop-2-en-1-imine oxide
CID 5364539
10-Oxido-1,2,3,4,4a,5,6,7-octahydroacridin-10-ium
CID 87120771
(2Z)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide
CID 5370834
(E)-3-(cyclohexen-1-yl)-N-cyclohexylprop-2-en-1-imine oxide
CID 21159859
N-cyclohexyl-4-methylpent-3-en-2-imine oxide
CID 44520123

Frequently Asked Questions

What is the IUPAC name of (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide?
The IUPAC name of (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide (CID 21160446) is (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide.
What is the SMILES notation for (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide?
The canonical SMILES for (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide is CC1=CCCC/C1=C\C=[N+](\[O-])C1CCCCC1.
What is the InChIKey of (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide?
The InChIKey is UQDWBNLJVDYGNM-MHMBTURYSA-N. The full InChI is InChI=1S/C15H23NO/c1-13-7-5-6-8-14(13)11-12-16(17)15-9-3-2-4-10-15/h7,11-12,15H,2-6,8-10H2,1H3/b14-11+,16-12+.
What are the key properties of (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide?
(2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide has a molecular weight of 233.35 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-cyclohexyl-2-(2-methylcyclohex-2-en-1-ylidene)ethanimine oxide is sourced from PubChem (CID 21160446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).