4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine

C14H20N2O — CID 66875825

IUPAC4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine
SMILESCC1NCCc2c1cccc2N1CCOCC1
InChIInChI=1S/C14H20N2O/c1-11-12-3-2-4-14(13(12)5-6-15-11)16-7-9-17-10-8-16/h2-4,11,15H,5-10H2,1H3
InChIKeyUBXZMNYMSOEDNU-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.73
Rot. Bonds1

About 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine

4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine (PubChem CID 66875825) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine.

Molecular Properties

Compound Name4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine
PubChem CID66875825
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine
SMILESCC1NCCc2c1cccc2N1CCOCC1
InChIInChI=1S/C14H20N2O/c1-11-12-3-2-4-14(13(12)5-6-15-11)16-7-9-17-10-8-16/h2-4,11,15H,5-10H2,1H3
InChIKeyUBXZMNYMSOEDNU-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Morpholinepropanamine, N-1-naphthalenyl-
CID 78898
(2-(Morpholin-4-yl)phenyl)methanamine
CID 2776563
N-(2,3-dimethylphenyl)-2-morpholin-4-ylacetamide
CID 755358
7-benzyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 134139964
7-(cyclobutylmethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 134142903
7-propyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 134147456
(4aR)-7-propyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 162643595
4-(2-benzyl-3,4-dihydro-1H-isoquinolin-6-yl)morpholine
CID 132075278
4-Morpholineacetamide, N-(1,2,3,4-tetrahydro-2-methyl-4-phenyl-8-isoquinolinyl)-
CID 13452182
Acetamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-5-yl)-
CID 33930
1-(2,3-Dimethylphenyl)-3-[2-(morpholin-4-yl)ethyl]thiourea
CID 800454
(4aR)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 11171464

Frequently Asked Questions

What is the IUPAC name of 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine?
The IUPAC name of 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine (CID 66875825) is 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine.
What is the SMILES notation for 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine?
The canonical SMILES for 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine is CC1NCCc2c1cccc2N1CCOCC1.
What is the InChIKey of 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine?
The InChIKey is UBXZMNYMSOEDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11-12-3-2-4-14(13(12)5-6-15-11)16-7-9-17-10-8-16/h2-4,11,15H,5-10H2,1H3.
What are the key properties of 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine?
4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine has a molecular weight of 232.33 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)morpholine is sourced from PubChem (CID 66875825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).