2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide

C21H22N2O4 — CID 110324772

IUPAC2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
SMILESCCOc1ccc(CC(=O)NCc2cc3ccc(OC)cc3[nH]c2=O)cc1
InChIInChI=1S/C21H22N2O4/c1-3-27-17-7-4-14(5-8-17)10-20(24)22-13-16-11-15-6-9-18(26-2)12-19(15)23-21(16)25/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyQLAOSYYAYKDCDR-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.79
Rot. Bonds7

About 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide

2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide (PubChem CID 110324772) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
PubChem CID110324772
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC Name2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
SMILESCCOc1ccc(CC(=O)NCc2cc3ccc(OC)cc3[nH]c2=O)cc1
InChIInChI=1S/C21H22N2O4/c1-3-27-17-7-4-14(5-8-17)10-20(24)22-13-16-11-15-6-9-18(26-2)12-19(15)23-21(16)25/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyQLAOSYYAYKDCDR-UHFFFAOYSA-N
XLogP2.79
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-chlorophenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324770
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-(4-methylphenoxy)acetamide
CID 110324791
N-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 4258688
2-(4-chlorophenoxy)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324775
3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1,1-dimethylurea
CID 110324804
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]adamantane-1-carboxamide
CID 110324808
2-(3,4-dimethoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324558
N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
CID 1427665
2-(4-chlorophenoxy)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324899
N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]furan-2-carboxamide
CID 3283896
2-chloro-N-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]acetamide
CID 7136774
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 3430411

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The IUPAC name of 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide (CID 110324772) is 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide is CCOc1ccc(CC(=O)NCc2cc3ccc(OC)cc3[nH]c2=O)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The InChIKey is QLAOSYYAYKDCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c1-3-27-17-7-4-14(5-8-17)10-20(24)22-13-16-11-15-6-9-18(26-2)12-19(15)23-21(16)25/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide has a molecular weight of 366.42 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide is sourced from PubChem (CID 110324772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).