4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide

C20H19FN2O3 — CID 4889192

IUPAC4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
SMILESCOCCN(Cc1cc2ccccc2[nH]c1=O)C(=O)c1ccc(F)cc1
InChIInChI=1S/C20H19FN2O3/c1-26-11-10-23(20(25)14-6-8-17(21)9-7-14)13-16-12-15-4-2-3-5-18(15)22-19(16)24/h2-9,12H,10-11,13H2,1H3,(H,22,24)
InChIKeyWKKLSICBUQNDNX-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.96
Rot. Bonds6

About 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide

4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide (PubChem CID 4889192) has the molecular formula C20H19FN2O3 and a molecular weight of 354.38 g/mol. Its IUPAC name is 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
PubChem CID4889192
Molecular FormulaC20H19FN2O3
Molecular Weight354.38 g/mol
Exact Mass354.14
IUPAC Name4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
SMILESCOCCN(Cc1cc2ccccc2[nH]c1=O)C(=O)c1ccc(F)cc1
InChIInChI=1S/C20H19FN2O3/c1-26-11-10-23(20(25)14-6-8-17(21)9-7-14)13-16-12-15-4-2-3-5-18(15)22-19(16)24/h2-9,12H,10-11,13H2,1H3,(H,22,24)
InChIKeyWKKLSICBUQNDNX-UHFFFAOYSA-N
XLogP2.96
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 2987726
4-fluoro-N-(2-methylpropyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 4885893
N-ethyl-4-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 943147
N-[(2-oxo-1H-quinolin-3-yl)methyl]-N-propylpyridine-4-carboxamide
CID 934261
(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
CID 2036915
N-[(4-fluorophenyl)methyl]-4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1459110
N-butyl-2-methoxy-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 2067764
N-ethyl-2-fluoro-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 958945
N-benzyl-5-fluoro-N-(2-methoxyethyl)-1H-indole-2-carboxamide
CID 39999780
N-ethyl-3-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 945135
4-methyl-N-(4-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1417676
N-ethyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 945290

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The IUPAC name of 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide (CID 4889192) is 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide.
What is the SMILES notation for 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The canonical SMILES for 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide is COCCN(Cc1cc2ccccc2[nH]c1=O)C(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The InChIKey is WKKLSICBUQNDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O3/c1-26-11-10-23(20(25)14-6-8-17(21)9-7-14)13-16-12-15-4-2-3-5-18(15)22-19(16)24/h2-9,12H,10-11,13H2,1H3,(H,22,24).
What are the key properties of 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide?
4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide has a molecular weight of 354.38 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide is sourced from PubChem (CID 4889192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).