N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide

C16H9FN4O — CID 95763379

IUPACN-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
SMILESN#Cc1c(F)cccc1NC(=O)c1cnc2ccccc2n1
InChIInChI=1S/C16H9FN4O/c17-11-4-3-7-12(10(11)8-18)21-16(22)15-9-19-13-5-1-2-6-14(13)20-15/h1-7,9H,(H,21,22)
InChIKeyFGIXHMDMLLHAKO-UHFFFAOYSA-N
MW292.27 g/mol
LogP2.89
Rot. Bonds2

About N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide

N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide (PubChem CID 95763379) has the molecular formula C16H9FN4O and a molecular weight of 292.27 g/mol. Its IUPAC name is N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
PubChem CID95763379
Molecular FormulaC16H9FN4O
Molecular Weight292.27 g/mol
Exact Mass292.08
IUPAC NameN-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
SMILESN#Cc1c(F)cccc1NC(=O)c1cnc2ccccc2n1
InChIInChI=1S/C16H9FN4O/c17-11-4-3-7-12(10(11)8-18)21-16(22)15-9-19-13-5-1-2-6-14(13)20-15/h1-7,9H,(H,21,22)
InChIKeyFGIXHMDMLLHAKO-UHFFFAOYSA-N
XLogP2.89
TPSA78.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.27
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyano-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 63724379
6-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 62232716
6-[(2-cyano-3-fluorophenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43580818
N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62240838
4-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 43580727
N-(2-bromophenyl)quinoxaline-2-carboxamide
CID 17429565
6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide
CID 62155166
2-chloro-N-(2-cyano-3-fluorophenyl)pyridine-3-carboxamide
CID 43580726
N-(2-cyano-3-fluorophenyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 79487939
2-chloro-N-(2-cyano-3-fluorophenyl)-3-fluorobenzamide
CID 79035734
N-(2-cyano-3-fluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62235962
1-(2-chlorophenyl)-3-(2-cyano-3-fluorophenyl)urea
CID 43580526

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide?
The IUPAC name of N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide (CID 95763379) is N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide.
What is the SMILES notation for N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide?
The canonical SMILES for N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide is N#Cc1c(F)cccc1NC(=O)c1cnc2ccccc2n1.
What is the InChIKey of N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide?
The InChIKey is FGIXHMDMLLHAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9FN4O/c17-11-4-3-7-12(10(11)8-18)21-16(22)15-9-19-13-5-1-2-6-14(13)20-15/h1-7,9H,(H,21,22).
What are the key properties of N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide?
N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide has a molecular weight of 292.27 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide is sourced from PubChem (CID 95763379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).