N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide

C15H11FN2O2 — CID 107467342

IUPACN-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide
SMILESCOc1cccc(C#N)c1NC(=O)c1ccccc1F
InChIInChI=1S/C15H11FN2O2/c1-20-13-8-4-5-10(9-17)14(13)18-15(19)11-6-2-3-7-12(11)16/h2-8H,1H3,(H,18,19)
InChIKeyXAWNNUMTGXDZHP-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.96
Rot. Bonds3

About N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide

N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide (PubChem CID 107467342) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide
PubChem CID107467342
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC NameN-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide
SMILESCOc1cccc(C#N)c1NC(=O)c1ccccc1F
InChIInChI=1S/C15H11FN2O2/c1-20-13-8-4-5-10(9-17)14(13)18-15(19)11-6-2-3-7-12(11)16/h2-8H,1H3,(H,18,19)
InChIKeyXAWNNUMTGXDZHP-UHFFFAOYSA-N
XLogP2.96
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-cyano-6-methoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 107467316
2,4-diamino-N-(2-cyano-6-methoxyphenyl)benzamide
CID 107466376
N-(2-cyano-6-methoxyphenyl)-2,2,2-trifluoroacetamide
CID 107468131
2-chloro-N-(2-cyano-6-methoxyphenyl)-5-sulfanylbenzamide
CID 107469989
N-(2-cyano-6-methoxyphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 107467908
N-(2-cyano-6-methoxyphenyl)-1H-pyrazole-4-carboxamide
CID 107468068
3-chloro-N-(2-cyano-6-methoxyphenyl)benzamide
CID 107468118
4-(chloromethyl)-N-(2-cyano-6-methoxyphenyl)benzamide
CID 107467181
N-(2-cyano-6-methoxyphenyl)-2-fluorobenzenesulfonamide
CID 107467349
3-chloro-N-(2-cyano-6-methoxyphenyl)-5-methylbenzamide
CID 107468127
6-amino-N-(2-cyano-6-methoxyphenyl)pyridazine-3-carboxamide
CID 107469830
5-amino-N-(2-cyano-6-methoxyphenyl)pyridine-2-carboxamide
CID 107466429

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide?
The IUPAC name of N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide (CID 107467342) is N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide.
What is the SMILES notation for N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide?
The canonical SMILES for N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide is COc1cccc(C#N)c1NC(=O)c1ccccc1F.
What is the InChIKey of N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide?
The InChIKey is XAWNNUMTGXDZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c1-20-13-8-4-5-10(9-17)14(13)18-15(19)11-6-2-3-7-12(11)16/h2-8H,1H3,(H,18,19).
What are the key properties of N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide?
N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide has a molecular weight of 270.26 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-6-methoxyphenyl)-2-fluorobenzamide is sourced from PubChem (CID 107467342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).