N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide

C21H22N2O4 — CID 1396367

IUPACN-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
SMILESCCN(Cc1cc2ccc(OC)cc2[nH]c1=O)C(=O)COc1ccccc1
InChIInChI=1S/C21H22N2O4/c1-3-23(20(24)14-27-17-7-5-4-6-8-17)13-16-11-15-9-10-18(26-2)12-19(15)22-21(16)25/h4-12H,3,13-14H2,1-2H3,(H,22,25)
InChIKeyYIZYSVCPYYXHHV-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.96
Rot. Bonds7

About N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide

N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide (PubChem CID 1396367) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
PubChem CID1396367
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC NameN-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
SMILESCCN(Cc1cc2ccc(OC)cc2[nH]c1=O)C(=O)COc1ccccc1
InChIInChI=1S/C21H22N2O4/c1-3-23(20(24)14-27-17-7-5-4-6-8-17)13-16-11-15-9-10-18(26-2)12-19(15)22-21(16)25/h4-12H,3,13-14H2,1-2H3,(H,22,25)
InChIKeyYIZYSVCPYYXHHV-UHFFFAOYSA-N
XLogP2.96
TPSA71.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
CID 665147
N-ethyl-3-methoxy-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1427703
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxy-N-propan-2-ylacetamide
CID 665368
N-ethyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 945290
2-ethoxy-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylbenzamide
CID 3442794
N-butyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 3932848
N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
CID 1427665
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-methoxyphenyl)acetamide
CID 5036839
N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxy-N-propan-2-ylacetamide
CID 3341727
1-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-phenylethyl)thiourea
CID 1137517
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylfuran-2-carboxamide
CID 1421969
1-[2-(diethylamino)ethyl]-3-ethyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea
CID 3174084

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide?
The IUPAC name of N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide (CID 1396367) is N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide.
What is the SMILES notation for N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide?
The canonical SMILES for N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide is CCN(Cc1cc2ccc(OC)cc2[nH]c1=O)C(=O)COc1ccccc1.
What is the InChIKey of N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide?
The InChIKey is YIZYSVCPYYXHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c1-3-23(20(24)14-27-17-7-5-4-6-8-17)13-16-11-15-9-10-18(26-2)12-19(15)22-21(16)25/h4-12H,3,13-14H2,1-2H3,(H,22,25).
What are the key properties of N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide?
N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide has a molecular weight of 366.42 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide is sourced from PubChem (CID 1396367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).