2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide

C21H16F2N2O3 — CID 46487214

IUPAC2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide
SMILESCOc1ccc(NC(=O)c2ccccc2F)cc1NC(=O)c1cccc(F)c1
InChIInChI=1S/C21H16F2N2O3/c1-28-19-10-9-15(24-21(27)16-7-2-3-8-17(16)23)12-18(19)25-20(26)13-5-4-6-14(22)11-13/h2-12H,1H3,(H,24,27)(H,25,26)
InChIKeySGITUOYVTKHAPP-UHFFFAOYSA-N
MW382.37 g/mol
LogP4.48
Rot. Bonds5

About 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide

2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide (PubChem CID 46487214) has the molecular formula C21H16F2N2O3 and a molecular weight of 382.37 g/mol. Its IUPAC name is 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide
PubChem CID46487214
Molecular FormulaC21H16F2N2O3
Molecular Weight382.37 g/mol
Exact Mass382.11
IUPAC Name2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide
SMILESCOc1ccc(NC(=O)c2ccccc2F)cc1NC(=O)c1cccc(F)c1
InChIInChI=1S/C21H16F2N2O3/c1-28-19-10-9-15(24-21(27)16-7-2-3-8-17(16)23)12-18(19)25-20(26)13-5-4-6-14(22)11-13/h2-12H,1H3,(H,24,27)(H,25,26)
InChIKeySGITUOYVTKHAPP-UHFFFAOYSA-N
XLogP4.48
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.37
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethylsulfinyl-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide
CID 112827439
3-fluoro-N-[5-[[2-(3-fluorophenyl)acetyl]amino]-2-methoxyphenyl]benzamide
CID 55725735
3-fluoro-N-[2-methoxy-5-[[2-methyl-3-(methylamino)propanoyl]amino]phenyl]benzamide
CID 119709950
N-(3-amino-4-methoxyphenyl)-3-fluorobenzamide
CID 28866814
3-[(3-fluorobenzoyl)amino]-4-methoxybenzoic acid
CID 28667508
2,3,5-trichloro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]-6-hydroxybenzamide
CID 112827442
N-[5-(4-aminopentanoylamino)-2-methoxyphenyl]-3-fluorobenzamide
CID 120559883
N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 55725736
N-(3-acetamido-4-methoxyphenyl)-2,4-difluorobenzamide
CID 33307531
N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]-5-methyl-1-phenylpyrazole-3-carboxamide
CID 55779610
N-[5-[[4-(diethylsulfamoyl)benzoyl]amino]-2-methoxyphenyl]-3-fluorobenzamide
CID 46487202
N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]-3-(4-fluorophenyl)imidazole-4-carboxamide
CID 55725884

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide?
The IUPAC name of 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide (CID 46487214) is 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide?
The canonical SMILES for 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide is COc1ccc(NC(=O)c2ccccc2F)cc1NC(=O)c1cccc(F)c1.
What is the InChIKey of 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide?
The InChIKey is SGITUOYVTKHAPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F2N2O3/c1-28-19-10-9-15(24-21(27)16-7-2-3-8-17(16)23)12-18(19)25-20(26)13-5-4-6-14(22)11-13/h2-12H,1H3,(H,24,27)(H,25,26).
What are the key properties of 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide?
2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide has a molecular weight of 382.37 g/mol, XLogP of 4.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide is sourced from PubChem (CID 46487214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).