N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide

C19H19FN2O3 — CID 134036597

IUPACN-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCN(CCOc1ccccc1F)C(=O)C1CC(=O)Nc2ccccc21
InChIInChI=1S/C19H19FN2O3/c1-22(10-11-25-17-9-5-3-7-15(17)20)19(24)14-12-18(23)21-16-8-4-2-6-13(14)16/h2-9,14H,10-12H2,1H3,(H,21,23)
InChIKeyYXPWZMMHZRWSGG-UHFFFAOYSA-N
MW342.37 g/mol
LogP2.79
Rot. Bonds5

About N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide

N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide (PubChem CID 134036597) has the molecular formula C19H19FN2O3 and a molecular weight of 342.37 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
PubChem CID134036597
Molecular FormulaC19H19FN2O3
Molecular Weight342.37 g/mol
Exact Mass342.14
IUPAC NameN-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCN(CCOc1ccccc1F)C(=O)C1CC(=O)Nc2ccccc21
InChIInChI=1S/C19H19FN2O3/c1-22(10-11-25-17-9-5-3-7-15(17)20)19(24)14-12-18(23)21-16-8-4-2-6-13(14)16/h2-9,14H,10-12H2,1H3,(H,21,23)
InChIKeyYXPWZMMHZRWSGG-UHFFFAOYSA-N
XLogP2.79
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.37
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenoxy)ethyl]-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 78982144
N-(3-hydroxybutyl)-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 111695611
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 73420162
2-methyl-3-[methyl-(2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl)amino]propanoic acid
CID 119228113
N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide
CID 46966420
(4S)-7-fluoro-N-[(2-methoxyphenyl)methyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 29434660
(3R)-N-[2-(2-fluorophenoxy)ethyl]-N-methylpiperidine-3-carboxamide
CID 81129858
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-3-oxo-4H-1,4-benzoxazine-7-carboxamide
CID 26960552
4-amino-N-[2-(2-fluorophenoxy)ethyl]-N-methyloxolane-3-carboxamide
CID 66240651
N-[2-(2-fluorophenoxy)ethyl]-N,3-dimethylpiperidine-2-carboxamide
CID 107067637
(4S)-N-(3-amino-3-oxopropyl)-N-(4-fluorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 52550083
7-fluoro-N-methyl-2-oxo-N-[[2-(trifluoromethoxy)phenyl]methyl]-3,4-dihydro-1H-quinoline-4-carboxamide
CID 47021219

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide (CID 134036597) is N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide is CN(CCOc1ccccc1F)C(=O)C1CC(=O)Nc2ccccc21.
What is the InChIKey of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The InChIKey is YXPWZMMHZRWSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O3/c1-22(10-11-25-17-9-5-3-7-15(17)20)19(24)14-12-18(23)21-16-8-4-2-6-13(14)16/h2-9,14H,10-12H2,1H3,(H,21,23).
What are the key properties of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide has a molecular weight of 342.37 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide is sourced from PubChem (CID 134036597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).