2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine

C16H24N2O — CID 43562810

IUPAC2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine
SMILESCCC1CN(CC2Cc3ccccc3CN2)CCO1
InChIInChI=1S/C16H24N2O/c1-2-16-12-18(7-8-19-16)11-15-9-13-5-3-4-6-14(13)10-17-15/h3-6,15-17H,2,7-12H2,1H3
InChIKeyDUWZVAJYSFXIQH-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.81
Rot. Bonds3

About 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine

2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine (PubChem CID 43562810) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine.

Molecular Properties

Compound Name2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine
PubChem CID43562810
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine
SMILESCCC1CN(CC2Cc3ccccc3CN2)CCO1
InChIInChI=1S/C16H24N2O/c1-2-16-12-18(7-8-19-16)11-15-9-13-5-3-4-6-14(13)10-17-15/h3-6,15-17H,2,7-12H2,1H3
InChIKeyDUWZVAJYSFXIQH-UHFFFAOYSA-N
XLogP1.81
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline
CID 15697325
3-[(4-tert-butylpiperidin-1-yl)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 62085434
(3R)-3-[(4-benzylpiperazin-1-yl)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 112736433
(3S)-3-methyl-4-[[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]morpholine
CID 93111764
2-ethyl-4-(2-phenylethyl)morpholine
CID 59586000
2,4-diethylmorpholine
CID 58988021
(3S)-3-[2-(1,2,3,4-tetrahydroisoquinolin-3-yl)ethyl]-1,2,3,4-tetrahydroisoquinoline
CID 67709513
3-[(2,3,5-trimethylpiperidin-1-yl)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 114593838
[2-[2-(2-ethylmorpholin-4-yl)ethyl]phenyl]methanamine
CID 81321825
4-[(5-methoxy-1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]morpholine
CID 151491731
N-ethyl-N-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)ethanamine
CID 10822718
[2-(hydroxymethyl)morpholin-4-yl]-[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone
CID 81203025

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine?
The IUPAC name of 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine (CID 43562810) is 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine.
What is the SMILES notation for 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine?
The canonical SMILES for 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine is CCC1CN(CC2Cc3ccccc3CN2)CCO1.
What is the InChIKey of 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine?
The InChIKey is DUWZVAJYSFXIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-16-12-18(7-8-19-16)11-15-9-13-5-3-4-6-14(13)10-17-15/h3-6,15-17H,2,7-12H2,1H3.
What are the key properties of 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine?
2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine has a molecular weight of 260.38 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)morpholine is sourced from PubChem (CID 43562810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).