N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide

C14H10F2N4O — CID 62660264

IUPACN-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide
SMILESN#Cc1c(F)cccc1NC(=O)c1cccc(F)c1NN
InChIInChI=1S/C14H10F2N4O/c15-10-4-2-6-12(9(10)7-17)19-14(21)8-3-1-5-11(16)13(8)20-18/h1-6,20H,18H2,(H,19,21)
InChIKeyVJZCUNGROAOCSP-UHFFFAOYSA-N
MW288.26 g/mol
LogP2.37
Rot. Bonds3

About N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide

N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide (PubChem CID 62660264) has the molecular formula C14H10F2N4O and a molecular weight of 288.26 g/mol. Its IUPAC name is N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide.

Molecular Properties

Compound NameN-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide
PubChem CID62660264
Molecular FormulaC14H10F2N4O
Molecular Weight288.26 g/mol
Exact Mass288.08
IUPAC NameN-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide
SMILESN#Cc1c(F)cccc1NC(=O)c1cccc(F)c1NN
InChIInChI=1S/C14H10F2N4O/c15-10-4-2-6-12(9(10)7-17)19-14(21)8-3-1-5-11(16)13(8)20-18/h1-6,20H,18H2,(H,19,21)
InChIKeyVJZCUNGROAOCSP-UHFFFAOYSA-N
XLogP2.37
TPSA90.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.26
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide?
The IUPAC name of N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide (CID 62660264) is N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide.
What is the SMILES notation for N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide?
The canonical SMILES for N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide is N#Cc1c(F)cccc1NC(=O)c1cccc(F)c1NN.
What is the InChIKey of N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide?
The InChIKey is VJZCUNGROAOCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N4O/c15-10-4-2-6-12(9(10)7-17)19-14(21)8-3-1-5-11(16)13(8)20-18/h1-6,20H,18H2,(H,19,21).
What are the key properties of N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide?
N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide has a molecular weight of 288.26 g/mol, XLogP of 2.37, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide is sourced from PubChem (CID 62660264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).