1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one

C13H18N2O — CID 63105201

IUPAC1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one
SMILESCNC(C)c1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C13H18N2O/c1-9(14-2)10-4-6-12-11(8-10)5-7-13(16)15(12)3/h4,6,8-9,14H,5,7H2,1-3H3
InChIKeyZNUXQBUKMBIKGH-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.88
Rot. Bonds2

About 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one

1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one (PubChem CID 63105201) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one
PubChem CID63105201
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one
SMILESCNC(C)c1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C13H18N2O/c1-9(14-2)10-4-6-12-11(8-10)5-7-13(16)15(12)3/h4,6,8-9,14H,5,7H2,1-3H3
InChIKeyZNUXQBUKMBIKGH-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[2-amino-1-(methylamino)ethyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 116855688
1-methyl-6-[5-[1-(methylamino)ethyl]-3-pyridinyl]-3,4-dihydroquinolin-2-one
CID 146216610
6-(1-amino-2-methylpropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63105964
6-(1-hydroxypropan-2-yl)-1-methyl-3,4-dihydroquinolin-2-one
CID 117312785
6-(1-amino-2-hydroxypropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 116859555
6-[4-hydroxy-1-(methylamino)butyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 116952952
3-amino-3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)propanenitrile
CID 116851226
1-methyl-6-[1-(methylamino)heptyl]-3,4-dihydroquinolin-2-one
CID 114752545
1-methyl-6-(2,2,3,3,3-pentafluoro-1-hydroxypropyl)-3,4-dihydroquinolin-2-one
CID 63105598
6-(1-chloro-2,2,3,3,3-pentafluoropropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 63107266
6-(1-amino-2-chloroethyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 116937542
6-(1,3-diaminopropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 116932774

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one (CID 63105201) is 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one is CNC(C)c1ccc2c(c1)CCC(=O)N2C.
What is the InChIKey of 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one?
The InChIKey is ZNUXQBUKMBIKGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9(14-2)10-4-6-12-11(8-10)5-7-13(16)15(12)3/h4,6,8-9,14H,5,7H2,1-3H3.
What are the key properties of 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one?
1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one has a molecular weight of 218.30 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 63105201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).