5-amino-2-fluoro-N-(2-fluorophenyl)benzamide

C13H10F2N2O — CID 43510738

IUPAC5-amino-2-fluoro-N-(2-fluorophenyl)benzamide
SMILESNc1ccc(F)c(C(=O)Nc2ccccc2F)c1
InChIInChI=1S/C13H10F2N2O/c14-10-6-5-8(16)7-9(10)13(18)17-12-4-2-1-3-11(12)15/h1-7H,16H2,(H,17,18)
InChIKeyFURMGHQDZBTPAD-UHFFFAOYSA-N
MW248.23 g/mol
LogP2.80
Rot. Bonds2

About 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide

5-amino-2-fluoro-N-(2-fluorophenyl)benzamide (PubChem CID 43510738) has the molecular formula C13H10F2N2O and a molecular weight of 248.23 g/mol. Its IUPAC name is 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide.

Molecular Properties

Compound Name5-amino-2-fluoro-N-(2-fluorophenyl)benzamide
PubChem CID43510738
Molecular FormulaC13H10F2N2O
Molecular Weight248.23 g/mol
Exact Mass248.08
IUPAC Name5-amino-2-fluoro-N-(2-fluorophenyl)benzamide
SMILESNc1ccc(F)c(C(=O)Nc2ccccc2F)c1
InChIInChI=1S/C13H10F2N2O/c14-10-6-5-8(16)7-9(10)13(18)17-12-4-2-1-3-11(12)15/h1-7H,16H2,(H,17,18)
InChIKeyFURMGHQDZBTPAD-UHFFFAOYSA-N
XLogP2.80
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.23
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-(2-chlorophenyl)-2-fluorobenzamide
CID 43510734
5-bromo-2-fluoro-N-(2-fluorophenyl)benzamide
CID 24699182
1-(4-amino-2-chlorophenyl)-3-(2-fluorophenyl)urea
CID 16771122
4-amino-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 62155055
N-(2-amino-4-chlorophenyl)-2-fluorobenzamide
CID 16773651
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
5-amino-2-fluoro-N-(2-methoxy-4-methylphenyl)benzamide
CID 61117897
N-(4-amino-2-fluorophenyl)-2,3-dihydroxybenzamide
CID 114343189
5-amino-2,3-dichloro-N-(2,3-difluorophenyl)benzamide
CID 107183805
4-amino-2-[(5-bromo-2-fluorobenzoyl)amino]benzoic acid
CID 63116124
N-(4-amino-2-chlorophenyl)-2-chlorobenzamide
CID 960633
5-amino-2-fluoro-N-(3-hydroxypropyl)benzamide
CID 43510918

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide?
The IUPAC name of 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide (CID 43510738) is 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide.
What is the SMILES notation for 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide?
The canonical SMILES for 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide is Nc1ccc(F)c(C(=O)Nc2ccccc2F)c1.
What is the InChIKey of 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide?
The InChIKey is FURMGHQDZBTPAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2O/c14-10-6-5-8(16)7-9(10)13(18)17-12-4-2-1-3-11(12)15/h1-7H,16H2,(H,17,18).
What are the key properties of 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide?
5-amino-2-fluoro-N-(2-fluorophenyl)benzamide has a molecular weight of 248.23 g/mol, XLogP of 2.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-fluoro-N-(2-fluorophenyl)benzamide is sourced from PubChem (CID 43510738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).