2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide

C21H19FN2O — CID 18273886

IUPAC2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide
SMILESCc1cccc(Nc2ccccc2C(=O)Nc2ccccc2F)c1C
InChIInChI=1S/C21H19FN2O/c1-14-8-7-13-18(15(14)2)23-19-11-5-3-9-16(19)21(25)24-20-12-6-4-10-17(20)22/h3-13,23H,1-2H3,(H,24,25)
InChIKeyYDGPFOGKTQDUAI-UHFFFAOYSA-N
MW334.39 g/mol
LogP5.44
Rot. Bonds4

About 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide

2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide (PubChem CID 18273886) has the molecular formula C21H19FN2O and a molecular weight of 334.39 g/mol. Its IUPAC name is 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide.

Molecular Properties

Compound Name2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide
PubChem CID18273886
Molecular FormulaC21H19FN2O
Molecular Weight334.39 g/mol
Exact Mass334.15
IUPAC Name2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide
SMILESCc1cccc(Nc2ccccc2C(=O)Nc2ccccc2F)c1C
InChIInChI=1S/C21H19FN2O/c1-14-8-7-13-18(15(14)2)23-19-11-5-3-9-16(19)21(25)24-20-12-6-4-10-17(20)22/h3-13,23H,1-2H3,(H,24,25)
InChIKeyYDGPFOGKTQDUAI-UHFFFAOYSA-N
XLogP5.44
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.39
LogP ≤ 55.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetylphenyl)-2-(2,3-dimethylanilino)benzamide
CID 18207871
5-(2,3-dimethylanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109243282
copper 2-(2,3-dimethylanilino)benzoate
CID 135564277
N-(2-chloro-3-fluorophenyl)-2-methylbenzamide
CID 3784219
CID 10739949
CID 10739949
2-(ethylamino)-N-(2-fluorophenyl)benzamide
CID 55042608
deuterio 2-(2,3-dimethylanilino)benzoate
CID 175757896
2-[(2,3-dimethylphenyl)carbamoyl]benzoate
CID 6950917
2-amino-N-(2,3-difluorophenyl)-3-methylbenzamide
CID 61074628
N-(2-fluorophenyl)-2-methyl-3-nitrobenzamide
CID 710979
2-(2,3-dimethylanilino)-N-[2-[(4-hydroxybenzoyl)amino]ethyl]benzamide
CID 60517557
N-(2,3-dimethylphenyl)-2-(propan-2-ylcarbamoylamino)benzamide
CID 51216735

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide?
The IUPAC name of 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide (CID 18273886) is 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide.
What is the SMILES notation for 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide?
The canonical SMILES for 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide is Cc1cccc(Nc2ccccc2C(=O)Nc2ccccc2F)c1C.
What is the InChIKey of 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide?
The InChIKey is YDGPFOGKTQDUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O/c1-14-8-7-13-18(15(14)2)23-19-11-5-3-9-16(19)21(25)24-20-12-6-4-10-17(20)22/h3-13,23H,1-2H3,(H,24,25).
What are the key properties of 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide?
2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide has a molecular weight of 334.39 g/mol, XLogP of 5.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide is sourced from PubChem (CID 18273886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).