2-(3-amino-5-fluorophenoxy)benzamide

C13H11FN2O2 — CID 80753129

IUPAC2-(3-amino-5-fluorophenoxy)benzamide
SMILESNC(=O)c1ccccc1Oc1cc(N)cc(F)c1
InChIInChI=1S/C13H11FN2O2/c14-8-5-9(15)7-10(6-8)18-12-4-2-1-3-11(12)13(16)17/h1-7H,15H2,(H2,16,17)
InChIKeyFCHYBDFSBNCAFZ-UHFFFAOYSA-N
MW246.24 g/mol
LogP2.30
Rot. Bonds3

About 2-(3-amino-5-fluorophenoxy)benzamide

2-(3-amino-5-fluorophenoxy)benzamide (PubChem CID 80753129) has the molecular formula C13H11FN2O2 and a molecular weight of 246.24 g/mol. Its IUPAC name is 2-(3-amino-5-fluorophenoxy)benzamide.

Molecular Properties

Compound Name2-(3-amino-5-fluorophenoxy)benzamide
PubChem CID80753129
Molecular FormulaC13H11FN2O2
Molecular Weight246.24 g/mol
Exact Mass246.08
IUPAC Name2-(3-amino-5-fluorophenoxy)benzamide
SMILESNC(=O)c1ccccc1Oc1cc(N)cc(F)c1
InChIInChI=1S/C13H11FN2O2/c14-8-5-9(15)7-10(6-8)18-12-4-2-1-3-11(12)13(16)17/h1-7H,15H2,(H2,16,17)
InChIKeyFCHYBDFSBNCAFZ-UHFFFAOYSA-N
XLogP2.30
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.24
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(3-amino-5-fluorophenoxy)benzamide 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

2-(3-bromo-5-fluorophenoxy)benzamide
CID 81331712
2-(3-amino-5-methoxyphenoxy)benzamide
CID 80747937
2-amino-3-(3-bromo-5-fluorophenoxy)benzamide
CID 113333380
3-(2-tert-butylphenoxy)-5-fluoroaniline
CID 80753317
2-(3-chloro-5-fluorophenoxy)benzoic acid
CID 91575337
2-(3-methylphenoxy)benzamide
CID 70968841
2-fluoro-3-phenoxybenzamide
CID 58104414
2-(2-amino-4-fluoro-5-methylphenoxy)benzamide
CID 103590954
2-(4-amino-2-fluoro-5-methoxyphenoxy)benzamide
CID 107259815
3-(2-butan-2-ylphenoxy)-5-fluoroaniline
CID 80752812
5-fluoro-2-(3-phenylphenoxy)benzamide
CID 171776935
4-amino-3-(3,5-difluorophenoxy)benzamide
CID 55189641

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-5-fluorophenoxy)benzamide?
The IUPAC name of 2-(3-amino-5-fluorophenoxy)benzamide (CID 80753129) is 2-(3-amino-5-fluorophenoxy)benzamide.
What is the SMILES notation for 2-(3-amino-5-fluorophenoxy)benzamide?
The canonical SMILES for 2-(3-amino-5-fluorophenoxy)benzamide is NC(=O)c1ccccc1Oc1cc(N)cc(F)c1.
What is the InChIKey of 2-(3-amino-5-fluorophenoxy)benzamide?
The InChIKey is FCHYBDFSBNCAFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2/c14-8-5-9(15)7-10(6-8)18-12-4-2-1-3-11(12)13(16)17/h1-7H,15H2,(H2,16,17).
What are the key properties of 2-(3-amino-5-fluorophenoxy)benzamide?
2-(3-amino-5-fluorophenoxy)benzamide has a molecular weight of 246.24 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-5-fluorophenoxy)benzamide is sourced from PubChem (CID 80753129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).