4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine

C14H23NO — CID 90471503

IUPAC4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine
SMILESC/C=C1/C=C(N2CCOCC2)CC(C)(C)C1
InChIInChI=1S/C14H23NO/c1-4-12-9-13(11-14(2,3)10-12)15-5-7-16-8-6-15/h4,9H,5-8,10-11H2,1-3H3/b12-4-
InChIKeyUTOQXBAMXGKPKA-QCDXTXTGSA-N
MW221.34 g/mol
LogP2.97
Rot. Bonds1

About 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine

4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine (PubChem CID 90471503) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine.

Molecular Properties

Compound Name4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine
PubChem CID90471503
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine
SMILESC/C=C1/C=C(N2CCOCC2)CC(C)(C)C1
InChIInChI=1S/C14H23NO/c1-4-12-9-13(11-14(2,3)10-12)15-5-7-16-8-6-15/h4,9H,5-8,10-11H2,1-3H3/b12-4-
InChIKeyUTOQXBAMXGKPKA-QCDXTXTGSA-N
XLogP2.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine?
The IUPAC name of 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine (CID 90471503) is 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine.
What is the SMILES notation for 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine?
The canonical SMILES for 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine is C/C=C1/C=C(N2CCOCC2)CC(C)(C)C1.
What is the InChIKey of 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine?
The InChIKey is UTOQXBAMXGKPKA-QCDXTXTGSA-N. The full InChI is InChI=1S/C14H23NO/c1-4-12-9-13(11-14(2,3)10-12)15-5-7-16-8-6-15/h4,9H,5-8,10-11H2,1-3H3/b12-4-.
What are the key properties of 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine?
4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine has a molecular weight of 221.34 g/mol, XLogP of 2.97, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3E)-3-ethylidene-5,5-dimethylcyclohexen-1-yl]morpholine is sourced from PubChem (CID 90471503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).