2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide

C23H22N2O4 — CID 27279537

IUPAC2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide
SMILESCCOc1cc([C@H]2CC(=O)Nc3ccc4ccccc4c32)ccc1OCC(N)=O
InChIInChI=1S/C23H22N2O4/c1-2-28-20-11-15(8-10-19(20)29-13-21(24)26)17-12-22(27)25-18-9-7-14-5-3-4-6-16(14)23(17)18/h3-11,17H,2,12-13H2,1H3,(H2,24,26)(H,25,27)/t17-/m1/s1
InChIKeySVBRAIKKEFVHLZ-QGZVFWFLSA-N
MW390.44 g/mol
LogP3.58
Rot. Bonds6

About 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide

2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide (PubChem CID 27279537) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide
PubChem CID27279537
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide
SMILESCCOc1cc([C@H]2CC(=O)Nc3ccc4ccccc4c32)ccc1OCC(N)=O
InChIInChI=1S/C23H22N2O4/c1-2-28-20-11-15(8-10-19(20)29-13-21(24)26)17-12-22(27)25-18-9-7-14-5-3-4-6-16(14)23(17)18/h3-11,17H,2,12-13H2,1H3,(H2,24,26)(H,25,27)/t17-/m1/s1
InChIKeySVBRAIKKEFVHLZ-QGZVFWFLSA-N
XLogP3.58
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide with MolForge

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Related Compounds

(1S)-1-(4-ethoxy-3-methoxyphenyl)-2,4-dihydro-1H-benzo[f]quinolin-3-one
CID 2234146
(1R)-1-(3-ethoxyphenyl)-2,4-dihydro-1H-benzo[f]quinolin-3-one
CID 2231068
1-(3-methoxy-4-prop-2-ynoxyphenyl)-2,4-dihydro-1H-benzo[f]quinolin-3-one
CID 19590580
2-[4-(2-benzylsulfanyl-1-methyl-4,7-dioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-5-yl)-2-ethoxyphenoxy]acetamide
CID 23609543
2-[2-ethoxy-4-[1-(2-ethylphenyl)-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl]phenoxy]acetamide
CID 135756484
(1S)-1-(4-hydroxy-3,5-dimethoxyphenyl)-2,4-dihydro-1H-benzo[f]quinolin-3-one
CID 673087
2-[4-(4,7-dioxo-2-prop-2-ynylsulfanyl-3,5,6,8-tetrahydropyrido[2,3-d]pyrimidin-5-yl)-2-ethoxyphenoxy]acetamide
CID 135969237
2-[2-methoxy-4-[(4S)-6-oxo-3-phenyl-2,4,5,7-tetrahydropyrazolo[3,4-b]pyridin-4-yl]phenoxy]acetamide
CID 135906156
2-[2-ethoxy-4-[2-[(4-methylphenyl)methylsulfanyl]-4,7-dioxo-3,5,6,8-tetrahydropyrido[2,3-d]pyrimidin-5-yl]phenoxy]acetamide
CID 135969239
7-[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]-3-(4-methylphenyl)-5-oxo-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid
CID 53047046
7-[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]-3-(4-fluorophenyl)-5-oxo-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid
CID 53047090
(7S)-7-[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]-3-(4-fluorophenyl)-5-oxo-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid
CID 95061138

Frequently Asked Questions

What is the IUPAC name of 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide?
The IUPAC name of 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide (CID 27279537) is 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide?
The canonical SMILES for 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide is CCOc1cc([C@H]2CC(=O)Nc3ccc4ccccc4c32)ccc1OCC(N)=O.
What is the InChIKey of 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide?
The InChIKey is SVBRAIKKEFVHLZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-2-28-20-11-15(8-10-19(20)29-13-21(24)26)17-12-22(27)25-18-9-7-14-5-3-4-6-16(14)23(17)18/h3-11,17H,2,12-13H2,1H3,(H2,24,26)(H,25,27)/t17-/m1/s1.
What are the key properties of 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide?
2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide has a molecular weight of 390.44 g/mol, XLogP of 3.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-ethoxy-4-[(1R)-3-oxo-2,4-dihydro-1H-benzo[f]quinolin-1-yl]phenoxy]acetamide is sourced from PubChem (CID 27279537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).