2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine

C21H22N2O — CID 3276442

IUPAC2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine
SMILESCC1CN(c2cc(-c3ccccc3)c3ccccc3n2)CC(C)O1
InChIInChI=1S/C21H22N2O/c1-15-13-23(14-16(2)24-15)21-12-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)22-21/h3-12,15-16H,13-14H2,1-2H3
InChIKeyUZXIGSNSCQTFTO-UHFFFAOYSA-N
MW318.42 g/mol
LogP4.52
Rot. Bonds2

About 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine

2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine (PubChem CID 3276442) has the molecular formula C21H22N2O and a molecular weight of 318.42 g/mol. Its IUPAC name is 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine
PubChem CID3276442
Molecular FormulaC21H22N2O
Molecular Weight318.42 g/mol
Exact Mass318.17
IUPAC Name2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine
SMILESCC1CN(c2cc(-c3ccccc3)c3ccccc3n2)CC(C)O1
InChIInChI=1S/C21H22N2O/c1-15-13-23(14-16(2)24-15)21-12-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)22-21/h3-12,15-16H,13-14H2,1-2H3
InChIKeyUZXIGSNSCQTFTO-UHFFFAOYSA-N
XLogP4.52
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine?
The IUPAC name of 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine (CID 3276442) is 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine.
What is the SMILES notation for 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine?
The canonical SMILES for 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine is CC1CN(c2cc(-c3ccccc3)c3ccccc3n2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine?
The InChIKey is UZXIGSNSCQTFTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O/c1-15-13-23(14-16(2)24-15)21-12-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)22-21/h3-12,15-16H,13-14H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine?
2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine has a molecular weight of 318.42 g/mol, XLogP of 4.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(4-phenylquinolin-2-yl)morpholine is sourced from PubChem (CID 3276442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).