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

C15H22N2O — CID 82048427

IUPAC4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine
SMILESc1ccc2c(c1)CCNC2CCN1CCOCC1
InChIInChI=1S/C15H22N2O/c1-2-4-14-13(3-1)5-7-16-15(14)6-8-17-9-11-18-12-10-17/h1-4,15-16H,5-12H2
InChIKeyHFASWRPRRPAVKX-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.60
Rot. Bonds3

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

4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine (PubChem CID 82048427) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine
PubChem CID82048427
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine
SMILESc1ccc2c(c1)CCNC2CCN1CCOCC1
InChIInChI=1S/C15H22N2O/c1-2-4-14-13(3-1)5-7-16-15(14)6-8-17-9-11-18-12-10-17/h1-4,15-16H,5-12H2
InChIKeyHFASWRPRRPAVKX-UHFFFAOYSA-N
XLogP1.60
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-morpholin-4-ylethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
CID 21494271
5-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline;dihydrochloride
CID 21494283
1-[10-(1,2,3,4-tetrahydroisoquinolin-1-yl)decyl]-1,2,3,4-tetrahydroisoquinoline
CID 20976200
4-[2-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]ethyl]morpholine
CID 171396484
1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,2,3,4-tetrahydroisoquinoline
CID 112507559
1-[2-(azepan-1-yl)ethyl]-2,3-dihydro-1H-isoindole
CID 115105193
1-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinoline
CID 12743117
N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethanamine
CID 115104867
1,2,3,4-tetrahydroisoquinolin-1-ylmethanol
CID 51358587
(1S)-1-ethyl-1,2,3,4-tetrahydroisoquinoline
CID 40527795
1-(furan-2-ylmethyl)-1,2,3,4-tetrahydroisoquinoline
CID 83175633
3-(1,2,3,4-tetrahydroisoquinolin-1-ylmethyl)-8-oxa-3-azabicyclo[3.2.1]octane
CID 66371468

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine (CID 82048427) is 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine is c1ccc2c(c1)CCNC2CCN1CCOCC1.
What is the InChIKey of 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine?
The InChIKey is HFASWRPRRPAVKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-4-14-13(3-1)5-7-16-15(14)6-8-17-9-11-18-12-10-17/h1-4,15-16H,5-12H2.
What are the key properties of 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine?
4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine has a molecular weight of 246.35 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]morpholine is sourced from PubChem (CID 82048427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).