2-(2-fluoroanilino)-4-phenylbenzoic acid

C19H14FNO2 — CID 68958907

IUPAC2-(2-fluoroanilino)-4-phenylbenzoic acid
SMILESO=C(O)c1ccc(-c2ccccc2)cc1Nc1ccccc1F
InChIInChI=1S/C19H14FNO2/c20-16-8-4-5-9-17(16)21-18-12-14(10-11-15(18)19(22)23)13-6-2-1-3-7-13/h1-12,21H,(H,22,23)
InChIKeyDQMNRCMBOLNIDK-UHFFFAOYSA-N
MW307.32 g/mol
LogP4.93
Rot. Bonds4

About 2-(2-fluoroanilino)-4-phenylbenzoic acid

2-(2-fluoroanilino)-4-phenylbenzoic acid (PubChem CID 68958907) has the molecular formula C19H14FNO2 and a molecular weight of 307.32 g/mol. Its IUPAC name is 2-(2-fluoroanilino)-4-phenylbenzoic acid.

Molecular Properties

Compound Name2-(2-fluoroanilino)-4-phenylbenzoic acid
PubChem CID68958907
Molecular FormulaC19H14FNO2
Molecular Weight307.32 g/mol
Exact Mass307.10
IUPAC Name2-(2-fluoroanilino)-4-phenylbenzoic acid
SMILESO=C(O)c1ccc(-c2ccccc2)cc1Nc1ccccc1F
InChIInChI=1S/C19H14FNO2/c20-16-8-4-5-9-17(16)21-18-12-14(10-11-15(18)19(22)23)13-6-2-1-3-7-13/h1-12,21H,(H,22,23)
InChIKeyDQMNRCMBOLNIDK-UHFFFAOYSA-N
XLogP4.93
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.32
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-hydroxyanilino)-4-phenylbenzoic acid
CID 68960538
2-(2-nitroanilino)-4-phenylbenzoic acid
CID 68959849
2-(4-acetylanilino)-4-phenylbenzoic acid
CID 68960140
5-fluoro-2-(2-fluoroanilino)benzoic acid
CID 82296808
2-[(2,4-difluorobenzoyl)amino]-4-phenylbenzoic acid
CID 67343264
2-[2-(2-carboxyanilino)-4,5-difluoroanilino]benzoic acid
CID 10385313
4-(3-hydroxyphenyl)-2-(2-methylanilino)benzoic acid
CID 68962733
2-(isoquinolin-5-ylamino)-4-phenylbenzoic acid
CID 68958440
2-[(2-carboxybenzoyl)amino]-4-phenylbenzoic acid
CID 167346908
4-(4-tert-butylphenyl)-2-(4-fluoroanilino)benzoic acid
CID 68962853
2-benzamido-4-(3,4-difluorophenyl)benzoic acid
CID 67342195
4-(2-fluoroanilino)benzoic acid
CID 62231206

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroanilino)-4-phenylbenzoic acid?
The IUPAC name of 2-(2-fluoroanilino)-4-phenylbenzoic acid (CID 68958907) is 2-(2-fluoroanilino)-4-phenylbenzoic acid.
What is the SMILES notation for 2-(2-fluoroanilino)-4-phenylbenzoic acid?
The canonical SMILES for 2-(2-fluoroanilino)-4-phenylbenzoic acid is O=C(O)c1ccc(-c2ccccc2)cc1Nc1ccccc1F.
What is the InChIKey of 2-(2-fluoroanilino)-4-phenylbenzoic acid?
The InChIKey is DQMNRCMBOLNIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO2/c20-16-8-4-5-9-17(16)21-18-12-14(10-11-15(18)19(22)23)13-6-2-1-3-7-13/h1-12,21H,(H,22,23).
What are the key properties of 2-(2-fluoroanilino)-4-phenylbenzoic acid?
2-(2-fluoroanilino)-4-phenylbenzoic acid has a molecular weight of 307.32 g/mol, XLogP of 4.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroanilino)-4-phenylbenzoic acid is sourced from PubChem (CID 68958907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).