2-amino-4-fluorobenzamide

C7H7FN2O — CID 10241004

IUPAC2-amino-4-fluorobenzamide
SMILESNC(=O)c1ccc(F)cc1N
InChIInChI=1S/C7H7FN2O/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H2,10,11)
InChIKeyOAQNMGCVLKKYJF-UHFFFAOYSA-N
MW154.14 g/mol
LogP0.51
Rot. Bonds1

About 2-amino-4-fluorobenzamide

2-amino-4-fluorobenzamide (PubChem CID 10241004) has the molecular formula C7H7FN2O and a molecular weight of 154.14 g/mol. Its IUPAC name is 2-amino-4-fluorobenzamide.

Molecular Properties

Compound Name2-amino-4-fluorobenzamide
PubChem CID10241004
Molecular FormulaC7H7FN2O
Molecular Weight154.14 g/mol
Exact Mass154.05
IUPAC Name2-amino-4-fluorobenzamide
SMILESNC(=O)c1ccc(F)cc1N
InChIInChI=1S/C7H7FN2O/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H2,10,11)
InChIKeyOAQNMGCVLKKYJF-UHFFFAOYSA-N
XLogP0.51
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.14
LogP ≤ 50.51
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-4-fluorobenzamide?
The IUPAC name of 2-amino-4-fluorobenzamide (CID 10241004) is 2-amino-4-fluorobenzamide.
What is the SMILES notation for 2-amino-4-fluorobenzamide?
The canonical SMILES for 2-amino-4-fluorobenzamide is NC(=O)c1ccc(F)cc1N.
What is the InChIKey of 2-amino-4-fluorobenzamide?
The InChIKey is OAQNMGCVLKKYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2O/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H2,10,11).
What are the key properties of 2-amino-4-fluorobenzamide?
2-amino-4-fluorobenzamide has a molecular weight of 154.14 g/mol, XLogP of 0.51, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-fluorobenzamide is sourced from PubChem (CID 10241004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).