1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone

C17H24N2O2 — CID 65262062

IUPAC1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)C2CNCc3ccccc32)CC(C)(C)O1
InChIInChI=1S/C17H24N2O2/c1-12-10-19(11-17(2,3)21-12)16(20)15-9-18-8-13-6-4-5-7-14(13)15/h4-7,12,15,18H,8-11H2,1-3H3
InChIKeyIMVWZPKQGFPVNT-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.90
Rot. Bonds1

About 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone

1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone (PubChem CID 65262062) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone
PubChem CID65262062
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)C2CNCc3ccccc32)CC(C)(C)O1
InChIInChI=1S/C17H24N2O2/c1-12-10-19(11-17(2,3)21-12)16(20)15-9-18-8-13-6-4-5-7-14(13)15/h4-7,12,15,18H,8-11H2,1-3H3
InChIKeyIMVWZPKQGFPVNT-UHFFFAOYSA-N
XLogP1.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone?
The IUPAC name of 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone (CID 65262062) is 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone.
What is the SMILES notation for 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone?
The canonical SMILES for 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone is CC1CN(C(=O)C2CNCc3ccccc32)CC(C)(C)O1.
What is the InChIKey of 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone?
The InChIKey is IMVWZPKQGFPVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-12-10-19(11-17(2,3)21-12)16(20)15-9-18-8-13-6-4-5-7-14(13)15/h4-7,12,15,18H,8-11H2,1-3H3.
What are the key properties of 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone?
1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone has a molecular weight of 288.39 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydroisoquinolin-4-yl-(2,2,6-trimethylmorpholin-4-yl)methanone is sourced from PubChem (CID 65262062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).