4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride

C15H19ClN2O — CID 2789813

IUPAC4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride
SMILESCc1ccc2nc(C)cc(N3CCOCC3)c2c1.Cl
InChIInChI=1S/C15H18N2O.ClH/c1-11-3-4-14-13(9-11)15(10-12(2)16-14)17-5-7-18-8-6-17;/h3-4,9-10H,5-8H2,1-2H3;1H
InChIKeyZMZXLLDZIFBIHO-UHFFFAOYSA-N
MW278.78 g/mol
LogP3.11
Rot. Bonds1

About 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride

4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride (PubChem CID 2789813) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride.

Molecular Properties

Compound Name4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride
PubChem CID2789813
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride
SMILESCc1ccc2nc(C)cc(N3CCOCC3)c2c1.Cl
InChIInChI=1S/C15H18N2O.ClH/c1-11-3-4-14-13(9-11)15(10-12(2)16-14)17-5-7-18-8-6-17;/h3-4,9-10H,5-8H2,1-2H3;1H
InChIKeyZMZXLLDZIFBIHO-UHFFFAOYSA-N
XLogP3.11
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride?
The IUPAC name of 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride (CID 2789813) is 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride.
What is the SMILES notation for 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride?
The canonical SMILES for 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride is Cc1ccc2nc(C)cc(N3CCOCC3)c2c1.Cl.
What is the InChIKey of 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride?
The InChIKey is ZMZXLLDZIFBIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O.ClH/c1-11-3-4-14-13(9-11)15(10-12(2)16-14)17-5-7-18-8-6-17;/h3-4,9-10H,5-8H2,1-2H3;1H.
What are the key properties of 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride?
4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride has a molecular weight of 278.78 g/mol, XLogP of 3.11, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylquinolin-4-yl)morpholine;hydrochloride is sourced from PubChem (CID 2789813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).