1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide

C20H14FN3O3 — CID 86699720

IUPAC1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide
SMILESO=C1Cc2c(cccc2NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)N1
InChIInChI=1S/C20H14FN3O3/c21-12-6-8-13(9-7-12)24-10-2-3-14(20(24)27)19(26)23-17-5-1-4-16-15(17)11-18(25)22-16/h1-10H,11H2,(H,22,25)(H,23,26)
InChIKeyZSHWEIQRXLYVEY-UHFFFAOYSA-N
MW363.35 g/mol
LogP2.72
Rot. Bonds3

About 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide

1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide (PubChem CID 86699720) has the molecular formula C20H14FN3O3 and a molecular weight of 363.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide
PubChem CID86699720
Molecular FormulaC20H14FN3O3
Molecular Weight363.35 g/mol
Exact Mass363.10
IUPAC Name1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide
SMILESO=C1Cc2c(cccc2NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)N1
InChIInChI=1S/C20H14FN3O3/c21-12-6-8-13(9-7-12)24-10-2-3-14(20(24)27)19(26)23-17-5-1-4-16-15(17)11-18(25)22-16/h1-10H,11H2,(H,22,25)(H,23,26)
InChIKeyZSHWEIQRXLYVEY-UHFFFAOYSA-N
XLogP2.72
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.35
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3Z)-3-[[4-(dimethylamino)phenyl]methylidene]-1H-indol-2-one
CID 6450842
3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-o-tolyl-propionamide
CID 721309
3-Benzylideneindolin-2-one
CID 1551501
(3E)-3-{[4-(dimethylamino)phenyl]methylidene}-2,3-dihydro-1H-indol-2-one
CID 5353593
5-fluoro-1-(2-phenylethyl)-1H-indole-2,3-dione
CID 7678107
(2-Aminophenyl)(indolin-1-yl)methanone
CID 577461
(3E)-3-[[2-(4-methylpiperazin-1-yl)phenyl]methylidene]-1H-indol-2-one
CID 5703613
2,3-Dihydroindol-1-yl-(2-fluorophenyl)methanone
CID 579820
3-(4-Dimethylaminobenzylidenyl)-2-indolinone
CID 3135
4-(4-Benzyl-piperazin-1-yl)-1,3-dihydro-indol-2-one
CID 9995379
N-[(3-fluorophenyl)methyl]-N-methyl-2-oxo-1H-quinoline-4-carboxamide
CID 4883815
N-(3-acetamidophenyl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 6473240

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide (CID 86699720) is 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide is O=C1Cc2c(cccc2NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)N1.
What is the InChIKey of 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide?
The InChIKey is ZSHWEIQRXLYVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O3/c21-12-6-8-13(9-7-12)24-10-2-3-14(20(24)27)19(26)23-17-5-1-4-16-15(17)11-18(25)22-16/h1-10H,11H2,(H,22,25)(H,23,26).
What are the key properties of 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide?
1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide has a molecular weight of 363.35 g/mol, XLogP of 2.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-oxo-N-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 86699720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).