4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine

C11H20N2O — CID 107489754

IUPAC4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine
SMILESC1=C(CCN2CCOCC2)CCNC1
InChIInChI=1S/C11H20N2O/c1-4-12-5-2-11(1)3-6-13-7-9-14-10-8-13/h1,12H,2-10H2
InChIKeyZDKGTWQYORKTEJ-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.63
Rot. Bonds3

About 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine

4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine (PubChem CID 107489754) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine
PubChem CID107489754
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine
SMILESC1=C(CCN2CCOCC2)CCNC1
InChIInChI=1S/C11H20N2O/c1-4-12-5-2-11(1)3-6-13-7-9-14-10-8-13/h1,12H,2-10H2
InChIKeyZDKGTWQYORKTEJ-UHFFFAOYSA-N
XLogP0.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,7-dimethyl-N-(3-morpholin-4-ylpropyl)octa-2,6-dien-1-amine
CID 72671760
(6Z)-3,7,11-trimethyl-N-(3-morpholin-4-ylpropyl)dodeca-2,6,10-trien-1-amine
CID 156020897
2-[2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine
CID 113591697
2-[[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]morpholine
CID 114489989
1-(2-piperidin-4-yloxyethyl)-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine
CID 114490187
4-[2-Chloro-2-(4-piperidinylidene)ethyl]morpholine
CID 58804065
(2E,6E)-3,7,11-trimethyl-N-(3-morpholin-4-ylpropyl)dodeca-2,6,10-trien-1-amine
CID 60168425
(2E)-3,7-dimethyl-N-(3-morpholin-4-ylpropyl)octa-2,6-dien-1-amine
CID 60168518
3,7,11-trimethyl-N-(3-morpholin-4-ylpropyl)dodeca-2,6,10-trien-1-amine
CID 72671730
(2Z,4Z)-4-(2-morpholin-4-ylethyl)hexa-2,4-dien-1-amine
CID 89940285
4-[(2E)-2-pyrrolidin-3-ylideneethyl]morpholine
CID 115016235
4-(2-Piperidin-4-ylideneethyl)morpholine
CID 115020790

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine (CID 107489754) is 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine is C1=C(CCN2CCOCC2)CCNC1.
What is the InChIKey of 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine?
The InChIKey is ZDKGTWQYORKTEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-4-12-5-2-11(1)3-6-13-7-9-14-10-8-13/h1,12H,2-10H2.
What are the key properties of 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine?
4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine has a molecular weight of 196.29 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]morpholine is sourced from PubChem (CID 107489754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).