4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine

C19H30N2O2 — CID 112721481

IUPAC4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
SMILESCCOc1cc2c(cc1CN1CCOCC1)CCN(C)C2CC
InChIInChI=1S/C19H30N2O2/c1-4-18-17-13-19(23-5-2)16(12-15(17)6-7-20(18)3)14-21-8-10-22-11-9-21/h12-13,18H,4-11,14H2,1-3H3
InChIKeyFOWYPAJXTPIZJM-UHFFFAOYSA-N
MW318.46 g/mol
LogP2.86
Rot. Bonds5

About 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine

4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine (PubChem CID 112721481) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
PubChem CID112721481
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC Name4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
SMILESCCOc1cc2c(cc1CN1CCOCC1)CCN(C)C2CC
InChIInChI=1S/C19H30N2O2/c1-4-18-17-13-19(23-5-2)16(12-15(17)6-7-20(18)3)14-21-8-10-22-11-9-21/h12-13,18H,4-11,14H2,1-3H3
InChIKeyFOWYPAJXTPIZJM-UHFFFAOYSA-N
XLogP2.86
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
CID 112721569
7-ethoxy-1,2-dimethyl-6-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 112721477
[2-ethoxy-4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 84754907
3-ethoxy-4-(morpholin-4-ylmethyl)benzamide
CID 68978840
4-[3-(2-ethoxy-4-morpholin-4-ylphenyl)propyl]morpholine
CID 170870634
3-[(7-ethoxy-1,2-diethyl-3,4-dihydro-1H-isoquinolin-6-yl)methylamino]propan-1-ol
CID 83956373
N-[(7-ethoxy-1,2-dimethyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]-2,2,2-trifluoroethanamine
CID 83956328
1-[1-[(6-ethoxy-2,3-dihydro-1H-inden-5-yl)methyl]piperidin-4-yl]ethane-1,2-diol
CID 137338112
4-[3-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]propyl]morpholine
CID 170870160
4-[[2-methoxy-5-[3-(4-methylpiperazin-1-yl)propyl]phenyl]methyl]morpholine
CID 170863421
4-[(5-chloro-2-propoxyphenyl)methyl]morpholine;hydron;chloride
CID 660603
4-[2-(5-chloro-2-ethoxyphenyl)ethyl]morpholine;methanamine
CID 177027735

Frequently Asked Questions

What is the IUPAC name of 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
The IUPAC name of 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine (CID 112721481) is 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine.
What is the SMILES notation for 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
The canonical SMILES for 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine is CCOc1cc2c(cc1CN1CCOCC1)CCN(C)C2CC.
What is the InChIKey of 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
The InChIKey is FOWYPAJXTPIZJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-4-18-17-13-19(23-5-2)16(12-15(17)6-7-20(18)3)14-21-8-10-22-11-9-21/h12-13,18H,4-11,14H2,1-3H3.
What are the key properties of 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine has a molecular weight of 318.46 g/mol, XLogP of 2.86, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine is sourced from PubChem (CID 112721481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).