N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide

C19H17FN2O3 — CID 111566129

IUPACN-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide
SMILESO=C(Cn1ccc(=O)c2ccccc21)NCC(O)c1ccccc1F
InChIInChI=1S/C19H17FN2O3/c20-15-7-3-1-5-13(15)18(24)11-21-19(25)12-22-10-9-17(23)14-6-2-4-8-16(14)22/h1-10,18,24H,11-12H2,(H,21,25)
InChIKeyUZVDIPPSYZWQDG-UHFFFAOYSA-N
MW340.35 g/mol
LogP1.99
Rot. Bonds5

About N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide

N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide (PubChem CID 111566129) has the molecular formula C19H17FN2O3 and a molecular weight of 340.35 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide
PubChem CID111566129
Molecular FormulaC19H17FN2O3
Molecular Weight340.35 g/mol
Exact Mass340.12
IUPAC NameN-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide
SMILESO=C(Cn1ccc(=O)c2ccccc21)NCC(O)c1ccccc1F
InChIInChI=1S/C19H17FN2O3/c20-15-7-3-1-5-13(15)18(24)11-21-19(25)12-22-10-9-17(23)14-6-2-4-8-16(14)22/h1-10,18,24H,11-12H2,(H,21,25)
InChIKeyUZVDIPPSYZWQDG-UHFFFAOYSA-N
XLogP1.99
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-oxoquinolin-1-yl)-N-pentylacetamide
CID 47779055
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-(4-oxoquinolin-1-yl)acetamide
CID 119526495
N-(2-hydroxyphenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47840872
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-3-methylbutanamide
CID 71982886
N-(3-chloro-2-fluorophenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47780650
2-(6-fluoro-4-oxoquinolin-1-yl)-N-(2-methylpropyl)acetamide
CID 100742567
N-[(1S)-2-hydroxy-1-phenylethyl]-2-(4-oxoquinolin-1-yl)acetamide
CID 110001825
2-methyl-2-[[2-(4-oxoquinolin-1-yl)acetyl]amino]butanoic acid
CID 119199302
N-benzyl-2-(6-bromo-4-oxoquinolin-1-yl)acetamide
CID 100736190
N-[2-(2-fluorophenyl)-2-hydroxyethyl]pent-4-enamide
CID 111566124
1-(3,3-dimethyl-2-oxobutyl)quinolin-4-one
CID 62024225
N-[(2R)-2-(2,6-dichlorophenyl)-2-hydroxyethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 99810576

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide (CID 111566129) is N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide is O=C(Cn1ccc(=O)c2ccccc21)NCC(O)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide?
The InChIKey is UZVDIPPSYZWQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O3/c20-15-7-3-1-5-13(15)18(24)11-21-19(25)12-22-10-9-17(23)14-6-2-4-8-16(14)22/h1-10,18,24H,11-12H2,(H,21,25).
What are the key properties of N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide?
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide has a molecular weight of 340.35 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-(4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 111566129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).