4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide

C15H14FN3O2 — CID 73055344

IUPAC4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2ccccc2N)c(F)c1
InChIInChI=1S/C15H14FN3O2/c1-9(20)18-10-6-7-11(12(16)8-10)15(21)19-14-5-3-2-4-13(14)17/h2-8H,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyUDWAUBGZIALBQL-UHFFFAOYSA-N
MW287.29 g/mol
LogP2.62
Rot. Bonds3

About 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide

4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide (PubChem CID 73055344) has the molecular formula C15H14FN3O2 and a molecular weight of 287.29 g/mol. Its IUPAC name is 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide
PubChem CID73055344
Molecular FormulaC15H14FN3O2
Molecular Weight287.29 g/mol
Exact Mass287.11
IUPAC Name4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2ccccc2N)c(F)c1
InChIInChI=1S/C15H14FN3O2/c1-9(20)18-10-6-7-11(12(16)8-10)15(21)19-14-5-3-2-4-13(14)17/h2-8H,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyUDWAUBGZIALBQL-UHFFFAOYSA-N
XLogP2.62
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 52.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-acetamido-N-(2-aminophenyl)benzamide
CID 2746
5-acetamido-2-fluoro-N-(2-hydroxyphenyl)benzamide
CID 60571237
2-acetamido-N-(4-aminophenyl)benzamide;N-(4-aminophenyl)-2,4-difluorobenzamide
CID 70188641
N-(2-aminophenyl)-4-fluoro-2-hydroxybenzamide
CID 107012970
N-(5-acetamido-2-ethylphenyl)-2,4-difluorobenzamide
CID 108797375
N-(3-fluoro-4-iodophenyl)acetamide
CID 22991944
N-(2-aminophenyl)-2-chlorobenzamide
CID 684680
N-(4-acetamido-3-aminophenyl)acetamide;hydrochloride
CID 17385562
3-amino-N-(3,4-difluorophenyl)-2-fluorobenzamide
CID 150244858
N-(2-aminophenyl)-3-fluoro-5-methylbenzamide
CID 112701162
N-(4-acetamido-3-chlorophenyl)-2-aminobenzamide
CID 43402960
N-(5-acetamido-2-fluorophenyl)-4-fluoro-2-iodobenzamide
CID 55741246

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide?
The IUPAC name of 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide (CID 73055344) is 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide.
What is the SMILES notation for 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide?
The canonical SMILES for 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide is CC(=O)Nc1ccc(C(=O)Nc2ccccc2N)c(F)c1.
What is the InChIKey of 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide?
The InChIKey is UDWAUBGZIALBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2/c1-9(20)18-10-6-7-11(12(16)8-10)15(21)19-14-5-3-2-4-13(14)17/h2-8H,17H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide?
4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide has a molecular weight of 287.29 g/mol, XLogP of 2.62, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-(2-aminophenyl)-2-fluorobenzamide is sourced from PubChem (CID 73055344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).