2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide

C20H22N2O3 — CID 110788667

IUPAC2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide
SMILESCOc1cccc(CC(=O)NCCc2ccc3c(c2)CCC(=O)N3)c1
InChIInChI=1S/C20H22N2O3/c1-25-17-4-2-3-15(12-17)13-20(24)21-10-9-14-5-7-18-16(11-14)6-8-19(23)22-18/h2-5,7,11-12H,6,8-10,13H2,1H3,(H,21,24)(H,22,23)
InChIKeyISOSNIBCMLQNEZ-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.48
Rot. Bonds6

About 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide

2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide (PubChem CID 110788667) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide
PubChem CID110788667
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide
SMILESCOc1cccc(CC(=O)NCCc2ccc3c(c2)CCC(=O)N3)c1
InChIInChI=1S/C20H22N2O3/c1-25-17-4-2-3-15(12-17)13-20(24)21-10-9-14-5-7-18-16(11-14)6-8-19(23)22-18/h2-5,7,11-12H,6,8-10,13H2,1H3,(H,21,24)(H,22,23)
InChIKeyISOSNIBCMLQNEZ-UHFFFAOYSA-N
XLogP2.48
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768444
N-(3-methoxypropyl)-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768411
N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]-3-phenoxypropanamide
CID 110788637
2-oxo-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]propanamide
CID 115175903
N-[2-(4-hydroxyphenyl)ethyl]-2-(3-methoxyphenyl)acetamide
CID 61017914
2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 28711957
3,5-dimethoxy-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzamide
CID 110788429
N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopropanecarboxamide
CID 110788608
N-[2-(3-methoxyphenyl)ethyl]-2-(3-phenylmethoxyphenyl)acetamide
CID 13406973
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
6-[2-(methylamino)ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 82282846
N-[(2-methylphenyl)methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768423

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide (CID 110788667) is 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide is COc1cccc(CC(=O)NCCc2ccc3c(c2)CCC(=O)N3)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide?
The InChIKey is ISOSNIBCMLQNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-25-17-4-2-3-15(12-17)13-20(24)21-10-9-14-5-7-18-16(11-14)6-8-19(23)22-18/h2-5,7,11-12H,6,8-10,13H2,1H3,(H,21,24)(H,22,23).
What are the key properties of 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide?
2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide has a molecular weight of 338.41 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide is sourced from PubChem (CID 110788667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).