9H-carbazole;2-(4-fluorophenyl)acetic acid

C20H16FNO2 — CID 175926186

IUPAC9H-carbazole;2-(4-fluorophenyl)acetic acid
SMILESO=C(O)Cc1ccc(F)cc1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H9N.C8H7FO2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;9-7-3-1-6(2-4-7)5-8(10)11/h1-8,13H;1-4H,5H2,(H,10,11)
InChIKeyMOPCAVBQKSDIMB-UHFFFAOYSA-N
MW321.35 g/mol
LogP4.77
Rot. Bonds2

About 9H-carbazole;2-(4-fluorophenyl)acetic acid

9H-carbazole;2-(4-fluorophenyl)acetic acid (PubChem CID 175926186) has the molecular formula C20H16FNO2 and a molecular weight of 321.35 g/mol. Its IUPAC name is 9H-carbazole;2-(4-fluorophenyl)acetic acid.

Molecular Properties

Compound Name9H-carbazole;2-(4-fluorophenyl)acetic acid
PubChem CID175926186
Molecular FormulaC20H16FNO2
Molecular Weight321.35 g/mol
Exact Mass321.12
IUPAC Name9H-carbazole;2-(4-fluorophenyl)acetic acid
SMILESO=C(O)Cc1ccc(F)cc1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H9N.C8H7FO2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;9-7-3-1-6(2-4-7)5-8(10)11/h1-8,13H;1-4H,5H2,(H,10,11)
InChIKeyMOPCAVBQKSDIMB-UHFFFAOYSA-N
XLogP4.77
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.35
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 9H-carbazole;2-(4-fluorophenyl)acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-fluoro-1H-indol-3-yl)acetic acid
CID 22642493
9H-carbazole;carbonic acid
CID 67577328
9H-carbazole;propanoic acid
CID 68841226
2-(4-fluorophenyl)-1-(1H-indol-3-yl)ethanone
CID 43339236
2-[2-(4-fluorophenyl)-1H-indol-3-yl]acetic acid;piperidine
CID 161400298
2-(1-methyl-9H-carbazol-2-yl)acetic acid
CID 54249777
tris(2-phenylacetic acid);rhodium
CID 11168112
2-phenylacetic acid;silver
CID 50912513
2-phenylacetic acid;dihydrate
CID 168967514
copper 2-phenylacetic acid
CID 54609410
benzoic acid;9H-carbazole
CID 162147282
9H-carbazole
CID 66668984

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;2-(4-fluorophenyl)acetic acid?
The IUPAC name of 9H-carbazole;2-(4-fluorophenyl)acetic acid (CID 175926186) is 9H-carbazole;2-(4-fluorophenyl)acetic acid.
What is the SMILES notation for 9H-carbazole;2-(4-fluorophenyl)acetic acid?
The canonical SMILES for 9H-carbazole;2-(4-fluorophenyl)acetic acid is O=C(O)Cc1ccc(F)cc1.c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 9H-carbazole;2-(4-fluorophenyl)acetic acid?
The InChIKey is MOPCAVBQKSDIMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N.C8H7FO2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;9-7-3-1-6(2-4-7)5-8(10)11/h1-8,13H;1-4H,5H2,(H,10,11).
What are the key properties of 9H-carbazole;2-(4-fluorophenyl)acetic acid?
9H-carbazole;2-(4-fluorophenyl)acetic acid has a molecular weight of 321.35 g/mol, XLogP of 4.77, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;2-(4-fluorophenyl)acetic acid is sourced from PubChem (CID 175926186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).