N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide

C19H20N2O3 — CID 22548647

IUPACN-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
SMILESCOc1cccc(CNC(=O)CN2C(=O)CCc3ccccc32)c1
InChIInChI=1S/C19H20N2O3/c1-24-16-7-4-5-14(11-16)12-20-18(22)13-21-17-8-3-2-6-15(17)9-10-19(21)23/h2-8,11H,9-10,12-13H2,1H3,(H,20,22)
InChIKeyNSTONTATRHFFEA-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.29
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide

N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide (PubChem CID 22548647) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
PubChem CID22548647
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
SMILESCOc1cccc(CNC(=O)CN2C(=O)CCc3ccccc32)c1
InChIInChI=1S/C19H20N2O3/c1-24-16-7-4-5-14(11-16)12-20-18(22)13-21-17-8-3-2-6-15(17)9-10-19(21)23/h2-8,11H,9-10,12-13H2,1H3,(H,20,22)
InChIKeyNSTONTATRHFFEA-UHFFFAOYSA-N
XLogP2.29
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide (CID 22548647) is N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide is COc1cccc(CNC(=O)CN2C(=O)CCc3ccccc32)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The InChIKey is NSTONTATRHFFEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-24-16-7-4-5-14(11-16)12-20-18(22)13-21-17-8-3-2-6-15(17)9-10-19(21)23/h2-8,11H,9-10,12-13H2,1H3,(H,20,22).
What are the key properties of N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide has a molecular weight of 324.38 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide is sourced from PubChem (CID 22548647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).