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

C14H20N2O — CID 63940701

IUPAC2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine
SMILESCC1CN(C2CNCc3ccccc32)CCO1
InChIInChI=1S/C14H20N2O/c1-11-10-16(6-7-17-11)14-9-15-8-12-4-2-3-5-13(12)14/h2-5,11,14-15H,6-10H2,1H3
InChIKeyUAZOJRLNMKKRKG-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.55
Rot. Bonds1

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

2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine (PubChem CID 63940701) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine.

Molecular Properties

Compound Name2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine
PubChem CID63940701
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine
SMILESCC1CN(C2CNCc3ccccc32)CCO1
InChIInChI=1S/C14H20N2O/c1-11-10-16(6-7-17-11)14-9-15-8-12-4-2-3-5-13(12)14/h2-5,11,14-15H,6-10H2,1H3
InChIKeyUAZOJRLNMKKRKG-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine?
The IUPAC name of 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine (CID 63940701) is 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine.
What is the SMILES notation for 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine?
The canonical SMILES for 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine is CC1CN(C2CNCc3ccccc32)CCO1.
What is the InChIKey of 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine?
The InChIKey is UAZOJRLNMKKRKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11-10-16(6-7-17-11)14-9-15-8-12-4-2-3-5-13(12)14/h2-5,11,14-15H,6-10H2,1H3.
What are the key properties of 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine?
2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine has a molecular weight of 232.33 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(1,2,3,4-tetrahydroisoquinolin-4-yl)morpholine is sourced from PubChem (CID 63940701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).