6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one

C15H20N2O2 — CID 84638183

IUPAC6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one
SMILESCNCCc1c(C)c2cc(OC)ccc2n(C)c1=O
InChIInChI=1S/C15H20N2O2/c1-10-12(7-8-16-2)15(18)17(3)14-6-5-11(19-4)9-13(10)14/h5-6,9,16H,7-8H2,1-4H3
InChIKeyGDBCYFLFVYAVHY-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.62
Rot. Bonds4

About 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one

6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one (PubChem CID 84638183) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one.

Molecular Properties

Compound Name6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one
PubChem CID84638183
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one
SMILESCNCCc1c(C)c2cc(OC)ccc2n(C)c1=O
InChIInChI=1S/C15H20N2O2/c1-10-12(7-8-16-2)15(18)17(3)14-6-5-11(19-4)9-13(10)14/h5-6,9,16H,7-8H2,1-4H3
InChIKeyGDBCYFLFVYAVHY-UHFFFAOYSA-N
XLogP1.62
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one?
The IUPAC name of 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one (CID 84638183) is 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one.
What is the SMILES notation for 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one?
The canonical SMILES for 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one is CNCCc1c(C)c2cc(OC)ccc2n(C)c1=O.
What is the InChIKey of 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one?
The InChIKey is GDBCYFLFVYAVHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-12(7-8-16-2)15(18)17(3)14-6-5-11(19-4)9-13(10)14/h5-6,9,16H,7-8H2,1-4H3.
What are the key properties of 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one?
6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one has a molecular weight of 260.34 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,4-dimethyl-3-[2-(methylamino)ethyl]quinolin-2-one is sourced from PubChem (CID 84638183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).