4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine

C16H24N2O2 — CID 69000749

IUPAC4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine
SMILESCN1CCc2ccc(OCCN3CCOCC3)cc2C1
InChIInChI=1S/C16H24N2O2/c1-17-5-4-14-2-3-16(12-15(14)13-17)20-11-8-18-6-9-19-10-7-18/h2-3,12H,4-11,13H2,1H3
InChIKeyKPAHAIWGBGCOBS-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.39
Rot. Bonds4

About 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine

4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine (PubChem CID 69000749) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine
PubChem CID69000749
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine
SMILESCN1CCc2ccc(OCCN3CCOCC3)cc2C1
InChIInChI=1S/C16H24N2O2/c1-17-5-4-14-2-3-16(12-15(14)13-17)20-11-8-18-6-9-19-10-7-18/h2-3,12H,4-11,13H2,1H3
InChIKeyKPAHAIWGBGCOBS-UHFFFAOYSA-N
XLogP1.39
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine with MolForge

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Related Compounds

4-[2-(2,3-dihydro-1H-isoindol-5-yloxy)ethyl]morpholine
CID 66657088
4-[2-(7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]morpholine
CID 110456823
4-[2-(3-butoxyphenoxy)ethyl]morpholine
CID 2993436
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
4-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 3386987
6-ethoxy-2-methyl-3,4-dihydro-1H-isoquinoline;hydrochloride
CID 3029133
1-methyl-4-[2-[[7-[2-(4-methylpiperazin-1-yl)ethoxy]-9H-fluoren-2-yl]oxy]ethyl]piperazine
CID 86567481
ethane;4-[2-(3-methylphenoxy)ethyl]morpholine
CID 143019407
4-[2-[(2-methyl-1-benzofuran-6-yl)oxy]ethyl]morpholine
CID 143026753
4-[2-(4-tert-butyl-3-methylphenoxy)ethyl]morpholine
CID 59832136
4-[2-(7-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]morpholine
CID 59017452
2-methyl-5-(2-morpholin-4-ylethoxy)benzoic acid
CID 82165954

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine?
The IUPAC name of 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine (CID 69000749) is 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine is CN1CCc2ccc(OCCN3CCOCC3)cc2C1.
What is the InChIKey of 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine?
The InChIKey is KPAHAIWGBGCOBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-17-5-4-14-2-3-16(12-15(14)13-17)20-11-8-18-6-9-19-10-7-18/h2-3,12H,4-11,13H2,1H3.
What are the key properties of 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine?
4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine has a molecular weight of 276.38 g/mol, XLogP of 1.39, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine is sourced from PubChem (CID 69000749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).