6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one

C18H19NO3 — CID 2954320

IUPAC6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1cc2c(cc1OC)C(c1ccccc1C)CC(=O)N2
InChIInChI=1S/C18H19NO3/c1-11-6-4-5-7-12(11)13-9-18(20)19-15-10-17(22-3)16(21-2)8-14(13)15/h4-8,10,13H,9H2,1-3H3,(H,19,20)
InChIKeyFGSFYFLCAWPLAX-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.49
Rot. Bonds3

About 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one

6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 2954320) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID2954320
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1cc2c(cc1OC)C(c1ccccc1C)CC(=O)N2
InChIInChI=1S/C18H19NO3/c1-11-6-4-5-7-12(11)13-9-18(20)19-15-10-17(22-3)16(21-2)8-14(13)15/h4-8,10,13H,9H2,1-3H3,(H,19,20)
InChIKeyFGSFYFLCAWPLAX-UHFFFAOYSA-N
XLogP3.49
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-(4-hydroxy-3,5-dimethoxyphenyl)-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]quinolin-6-one
CID 2997123
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylbenzamide
CID 769398
9-(2-methoxyphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
CID 2943604
8-(2-ethoxyphenyl)-7,8-dihydro-(1,3)dioxolo(4,5-g)quinolin-6(5H)-one
CID 656346
Tetra-hydro-isoquinoline derivative 2
CID 46829772
8-(3,4,5-trimethoxyphenyl)-7,8-dihydro[1,3]dioxolo[4,5-g]quinolin-6(5H)-one
CID 3158408
N-(3,4-dimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 841491
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dimethylbenzamide
CID 1088351
3,4-Dihydro-6,7-dimethoxy-4-(2-(trifluoromethyl)phenyl)-2(1H)-quinolinone
CID 2938130
4-(3-Fluoro-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-quinolin-2-one
CID 2939802
4-(3-Chloro-phenyl)-6,7-dimethoxy-3,4-dihydro-1H-quinolin-2-one
CID 2954928
6,7-Dimethoxy-4-(3-methoxy-phenyl)-3,4-dihydro-1H-quinolin-2-one
CID 3158480

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one (CID 2954320) is 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one is COc1cc2c(cc1OC)C(c1ccccc1C)CC(=O)N2.
What is the InChIKey of 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is FGSFYFLCAWPLAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-11-6-4-5-7-12(11)13-9-18(20)19-15-10-17(22-3)16(21-2)8-14(13)15/h4-8,10,13H,9H2,1-3H3,(H,19,20).
What are the key properties of 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 297.35 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-4-(2-methylphenyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 2954320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).