Enfenamic Acid

C15H15NO2 — CID 31635

IUPAC2-(2-phenylethylamino)benzoic acid
SMILESC1=CC=C(C=C1)CCNC2=CC=CC=C2C(=O)O
InChIInChI=1S/C15H15NO2/c17-15(18)13-8-4-5-9-14(13)16-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2,(H,17,18)
InChIKeyHLNLBEFKHHCAMV-UHFFFAOYSA-N
MW241.28 g/mol
LogP4.00
Rot. Bonds5

About Enfenamic Acid

Enfenamic Acid (PubChem CID 31635) has the molecular formula C15H15NO2 and a molecular weight of 241.28 g/mol. Its IUPAC name is 2-(2-phenylethylamino)benzoic acid.

Molecular Properties

Compound NameEnfenamic Acid
PubChem CID31635
Molecular FormulaC15H15NO2
Molecular Weight241.28 g/mol
Exact Mass241.11
IUPAC Name2-(2-phenylethylamino)benzoic acid
SMILESC1=CC=C(C=C1)CCNC2=CC=CC=C2C(=O)O
InChIInChI=1S/C15H15NO2/c17-15(18)13-8-4-5-9-14(13)16-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2,(H,17,18)
InChIKeyHLNLBEFKHHCAMV-UHFFFAOYSA-N
XLogP4.00
TPSA49.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity261

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.28
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Anthranilic Acid
CID 227
Mefenamic Acid
CID 4044
Flufenamic Acid
CID 3371
Methyl N-methylanthranilate
CID 6826
Tolfenamic Acid
CID 610479
N-Phenylanthranilic Acid
CID 4386
N-acetylanthranilic acid
CID 6971
N-Methylanthranilic acid
CID 67069
Ethyl N-methylanthranilate
CID 101365
Methyl n-formylanthranilate
CID 162458
Phthalanilic acid
CID 78458
Formylanthranilic acid
CID 101399

Frequently Asked Questions

What is the IUPAC name of Enfenamic Acid?
The IUPAC name of Enfenamic Acid (CID 31635) is 2-(2-phenylethylamino)benzoic acid.
What is the SMILES notation for Enfenamic Acid?
The canonical SMILES for Enfenamic Acid is C1=CC=C(C=C1)CCNC2=CC=CC=C2C(=O)O.
What is the InChIKey of Enfenamic Acid?
The InChIKey is HLNLBEFKHHCAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c17-15(18)13-8-4-5-9-14(13)16-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2,(H,17,18).
What are the key properties of Enfenamic Acid?
Enfenamic Acid has a molecular weight of 241.28 g/mol, XLogP of 4.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Enfenamic Acid is sourced from PubChem (CID 31635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).