2-amino-5-(4-fluorophenyl)benzamide

C13H11FN2O — CID 25190922

IUPAC2-amino-5-(4-fluorophenyl)benzamide
SMILESNC(=O)c1cc(-c2ccc(F)cc2)ccc1N
InChIInChI=1S/C13H11FN2O/c14-10-4-1-8(2-5-10)9-3-6-12(15)11(7-9)13(16)17/h1-7H,15H2,(H2,16,17)
InChIKeyDGBJOLUYPDVPFN-UHFFFAOYSA-N
MW230.24 g/mol
LogP2.17
Rot. Bonds2

About 2-amino-5-(4-fluorophenyl)benzamide

2-amino-5-(4-fluorophenyl)benzamide (PubChem CID 25190922) has the molecular formula C13H11FN2O and a molecular weight of 230.24 g/mol. Its IUPAC name is 2-amino-5-(4-fluorophenyl)benzamide.

Molecular Properties

Compound Name2-amino-5-(4-fluorophenyl)benzamide
PubChem CID25190922
Molecular FormulaC13H11FN2O
Molecular Weight230.24 g/mol
Exact Mass230.09
IUPAC Name2-amino-5-(4-fluorophenyl)benzamide
SMILESNC(=O)c1cc(-c2ccc(F)cc2)ccc1N
InChIInChI=1S/C13H11FN2O/c14-10-4-1-8(2-5-10)9-3-6-12(15)11(7-9)13(16)17/h1-7H,15H2,(H2,16,17)
InChIKeyDGBJOLUYPDVPFN-UHFFFAOYSA-N
XLogP2.17
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(4-fluorophenyl)benzamide?
The IUPAC name of 2-amino-5-(4-fluorophenyl)benzamide (CID 25190922) is 2-amino-5-(4-fluorophenyl)benzamide.
What is the SMILES notation for 2-amino-5-(4-fluorophenyl)benzamide?
The canonical SMILES for 2-amino-5-(4-fluorophenyl)benzamide is NC(=O)c1cc(-c2ccc(F)cc2)ccc1N.
What is the InChIKey of 2-amino-5-(4-fluorophenyl)benzamide?
The InChIKey is DGBJOLUYPDVPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O/c14-10-4-1-8(2-5-10)9-3-6-12(15)11(7-9)13(16)17/h1-7H,15H2,(H2,16,17).
What are the key properties of 2-amino-5-(4-fluorophenyl)benzamide?
2-amino-5-(4-fluorophenyl)benzamide has a molecular weight of 230.24 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(4-fluorophenyl)benzamide is sourced from PubChem (CID 25190922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).