4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine

C19H35NO2 — CID 57174545

IUPAC4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine
SMILESCCOCCCC=CCC1(N2CCOCC2)CCCCC1C
InChIInChI=1S/C19H35NO2/c1-3-21-15-9-5-4-7-11-19(12-8-6-10-18(19)2)20-13-16-22-17-14-20/h4,7,18H,3,5-6,8-17H2,1-2H3
InChIKeyYXYFKLKRDIGKCN-UHFFFAOYSA-N
MW309.49 g/mol
LogP4.03
Rot. Bonds8

About 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine

4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine (PubChem CID 57174545) has the molecular formula C19H35NO2 and a molecular weight of 309.49 g/mol. Its IUPAC name is 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine.

Molecular Properties

Compound Name4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine
PubChem CID57174545
Molecular FormulaC19H35NO2
Molecular Weight309.49 g/mol
Exact Mass309.27
IUPAC Name4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine
SMILESCCOCCCC=CCC1(N2CCOCC2)CCCCC1C
InChIInChI=1S/C19H35NO2/c1-3-21-15-9-5-4-7-11-19(12-8-6-10-18(19)2)20-13-16-22-17-14-20/h4,7,18H,3,5-6,8-17H2,1-2H3
InChIKeyYXYFKLKRDIGKCN-UHFFFAOYSA-N
XLogP4.03
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.49
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[1-(7-Ethoxyhept-2-enyl)-2-methylcyclohexyl]morpholine
CID 57265762
4-[1-(4-Ethylcyclohex-2-en-1-yl)-2-methylpropan-2-yl]morpholine
CID 139440990
4-[2-(1,2,4a,5,6,7,8,8a-Octahydronaphthalen-1-yl)propyl]morpholine
CID 141103685
4-[(1S,4S)-2-[(5E)-5-ethylidene-2-methylcyclohexyl]-4-methylcyclohexyl]morpholine
CID 143189212

Frequently Asked Questions

What is the IUPAC name of 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine?
The IUPAC name of 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine (CID 57174545) is 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine.
What is the SMILES notation for 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine?
The canonical SMILES for 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine is CCOCCCC=CCC1(N2CCOCC2)CCCCC1C.
What is the InChIKey of 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine?
The InChIKey is YXYFKLKRDIGKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO2/c1-3-21-15-9-5-4-7-11-19(12-8-6-10-18(19)2)20-13-16-22-17-14-20/h4,7,18H,3,5-6,8-17H2,1-2H3.
What are the key properties of 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine?
4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine has a molecular weight of 309.49 g/mol, XLogP of 4.03, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(6-ethoxyhex-2-enyl)-2-methylcyclohexyl]morpholine is sourced from PubChem (CID 57174545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).