2-amino-N-(3-chlorophenyl)-3-fluorobenzamide

C13H10ClFN2O — CID 62650234

IUPAC2-amino-N-(3-chlorophenyl)-3-fluorobenzamide
SMILESNc1c(F)cccc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C13H10ClFN2O/c14-8-3-1-4-9(7-8)17-13(18)10-5-2-6-11(15)12(10)16/h1-7H,16H2,(H,17,18)
InChIKeyZLSTYNASNRIZOL-UHFFFAOYSA-N
MW264.69 g/mol
LogP3.31
Rot. Bonds2

About 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide

2-amino-N-(3-chlorophenyl)-3-fluorobenzamide (PubChem CID 62650234) has the molecular formula C13H10ClFN2O and a molecular weight of 264.69 g/mol. Its IUPAC name is 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide.

Molecular Properties

Compound Name2-amino-N-(3-chlorophenyl)-3-fluorobenzamide
PubChem CID62650234
Molecular FormulaC13H10ClFN2O
Molecular Weight264.69 g/mol
Exact Mass264.05
IUPAC Name2-amino-N-(3-chlorophenyl)-3-fluorobenzamide
SMILESNc1c(F)cccc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C13H10ClFN2O/c14-8-3-1-4-9(7-8)17-13(18)10-5-2-6-11(15)12(10)16/h1-7H,16H2,(H,17,18)
InChIKeyZLSTYNASNRIZOL-UHFFFAOYSA-N
XLogP3.31
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.69
LogP ≤ 53.31
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

N-(3-chlorophenyl)-2-fluorobenzamide
CID 531935
2-amino-N-(2-bromo-4-chlorophenyl)-3-fluorobenzamide
CID 81275442
2-amino-N-[4-chloro-3-(trifluoromethyl)phenyl]-3-fluorobenzamide
CID 110452028
2-amino-N-(3-chlorophenyl)-4-fluorobenzamide
CID 55177097
2-amino-N-(3-chlorophenyl)-3-nitrobenzamide
CID 115677622
2-amino-3-fluoro-N-(3-nitrophenyl)benzamide
CID 62650434
2-amino-N-(3,5-dimethylphenyl)-3-fluorobenzamide
CID 62649761
N-(3-amino-4-fluorophenyl)-2-chloro-3-fluorobenzamide
CID 81453774
5-chloro-N-(3-chlorophenyl)-2-hydrazinylbenzamide
CID 55052324
2-amino-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 62155044
N-(3,5-dichlorophenyl)-2,3-difluorobenzamide
CID 62650988
2-amino-3-fluoro-N-(3-fluoro-4-methoxyphenyl)benzamide
CID 62661511

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide?
The IUPAC name of 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide (CID 62650234) is 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide.
What is the SMILES notation for 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide?
The canonical SMILES for 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide is Nc1c(F)cccc1C(=O)Nc1cccc(Cl)c1.
What is the InChIKey of 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide?
The InChIKey is ZLSTYNASNRIZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O/c14-8-3-1-4-9(7-8)17-13(18)10-5-2-6-11(15)12(10)16/h1-7H,16H2,(H,17,18).
What are the key properties of 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide?
2-amino-N-(3-chlorophenyl)-3-fluorobenzamide has a molecular weight of 264.69 g/mol, XLogP of 3.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-chlorophenyl)-3-fluorobenzamide is sourced from PubChem (CID 62650234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).