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

C17H26N2O2 — CID 112721569

IUPAC4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
SMILESCCOc1cc2c(cc1CN1CCOCC1)CCN(C)C2
InChIInChI=1S/C17H26N2O2/c1-3-21-17-11-15-12-18(2)5-4-14(15)10-16(17)13-19-6-8-20-9-7-19/h10-11H,3-9,12-13H2,1-2H3
InChIKeyGFISMONTTYRKBQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.91
Rot. Bonds4

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

4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine (PubChem CID 112721569) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
PubChem CID112721569
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
SMILESCCOc1cc2c(cc1CN1CCOCC1)CCN(C)C2
InChIInChI=1S/C17H26N2O2/c1-3-21-17-11-15-12-18(2)5-4-14(15)10-16(17)13-19-6-8-20-9-7-19/h10-11H,3-9,12-13H2,1-2H3
InChIKeyGFISMONTTYRKBQ-UHFFFAOYSA-N
XLogP1.91
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(7-ethoxy-1-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine
CID 112721481
6-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
CID 134564645
7-methoxy-2-methyl-6-(piperazin-1-ylmethyl)-3,4-dihydro-1H-isoquinoline
CID 83956913
6,7-diethyl-2-methyl-3,4-dihydro-1H-isoquinoline
CID 155395760
4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine
CID 69000749
7-ethoxy-1,2-dimethyl-6-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 112721477
4-[(7-tert-butyl-2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)methyl]morpholine
CID 171575501
3-ethoxy-4-(morpholin-4-ylmethyl)benzamide
CID 68978840
[2-ethoxy-4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 84754907
1-[1-[(6-ethoxy-2,3-dihydro-1H-inden-5-yl)methyl]piperidin-4-yl]ethane-1,2-diol
CID 137338112
7-ethoxy-3-methyl-6-(piperidin-1-ylmethyl)-2-propyl-3,4-dihydro-1H-isoquinoline
CID 112721505
7-ethoxy-6-ethyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
CID 139399459

Frequently Asked Questions

What is the IUPAC name of 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
The IUPAC name of 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine (CID 112721569) is 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine.
What is the SMILES notation for 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
The canonical SMILES for 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine is CCOc1cc2c(cc1CN1CCOCC1)CCN(C)C2.
What is the InChIKey of 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
The InChIKey is GFISMONTTYRKBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-21-17-11-15-12-18(2)5-4-14(15)10-16(17)13-19-6-8-20-9-7-19/h10-11H,3-9,12-13H2,1-2H3.
What are the key properties of 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine?
4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine has a molecular weight of 290.41 g/mol, XLogP of 1.91, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(7-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methyl]morpholine is sourced from PubChem (CID 112721569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).