4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one

C20H23NO5 — CID 3242555

IUPAC4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one
SMILESCCOc1ccccc1C1CC(=O)Nc2cc(OC)c(OC)c(OC)c21
InChIInChI=1S/C20H23NO5/c1-5-26-15-9-7-6-8-12(15)13-10-17(22)21-14-11-16(23-2)19(24-3)20(25-4)18(13)14/h6-9,11,13H,5,10H2,1-4H3,(H,21,22)
InChIKeyYDHIVRPRJKHEDO-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.59
Rot. Bonds6

About 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one

4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 3242555) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID3242555
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one
SMILESCCOc1ccccc1C1CC(=O)Nc2cc(OC)c(OC)c(OC)c21
InChIInChI=1S/C20H23NO5/c1-5-26-15-9-7-6-8-12(15)13-10-17(22)21-14-11-16(23-2)19(24-3)20(25-4)18(13)14/h6-9,11,13H,5,10H2,1-4H3,(H,21,22)
InChIKeyYDHIVRPRJKHEDO-UHFFFAOYSA-N
XLogP3.59
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one (CID 3242555) is 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one is CCOc1ccccc1C1CC(=O)Nc2cc(OC)c(OC)c(OC)c21.
What is the InChIKey of 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is YDHIVRPRJKHEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-5-26-15-9-7-6-8-12(15)13-10-17(22)21-14-11-16(23-2)19(24-3)20(25-4)18(13)14/h6-9,11,13H,5,10H2,1-4H3,(H,21,22).
What are the key properties of 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one?
4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 357.41 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenyl)-5,6,7-trimethoxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 3242555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).