3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid

Name: 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₁H₁₀FNO₂ — CID 151683948

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid

SMILESO=C(O)N1CC=C(c2ccccc2F)C1

InChIInChI=1S/C11H10FNO2/c12-10-4-2-1-3-9(10)8-5-6-13(7-8)11(14)15/h1-5H,6-7H2,(H,14,15)

InChIKeyRBCZGIHPQLWUQZ-UHFFFAOYSA-N

MW207.20 g/mol

LogP2.20

Rot. Bonds1

About 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid

3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid (PubChem CID 151683948) has the molecular formula C₁₁H₁₀FNO₂ and a molecular weight of 207.20 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid.

Molecular Properties

Compound Name	3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid
PubChem CID	151683948
Molecular Formula	C₁₁H₁₀FNO₂
Molecular Weight	207.20 g/mol
Exact Mass	207.07
IUPAC Name	3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid
SMILES	O=C(O)N1CC=C(c2ccccc2F)C1
InChI	InChI=1S/C11H10FNO2/c12-10-4-2-1-3-9(10)8-5-6-13(7-8)11(14)15/h1-5H,6-7H2,(H,14,15)
InChIKey	RBCZGIHPQLWUQZ-UHFFFAOYSA-N
XLogP	2.20
TPSA	40.54 Å²
H-Bond Donors	1
H-Bond Acceptors	1
Rotatable Bonds	1
Heavy Atoms	15
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	207.20
LogP ≤ 5	2.20
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid?

The IUPAC name of 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid (CID 151683948) is 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid.

What is the SMILES notation for 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid?

The canonical SMILES for 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid is O=C(O)N1CC=C(c2ccccc2F)C1.

What is the InChIKey of 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid?

The InChIKey is RBCZGIHPQLWUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO2/c12-10-4-2-1-3-9(10)8-5-6-13(7-8)11(14)15/h1-5H,6-7H2,(H,14,15).

What are the key properties of 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid?

3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid has a molecular weight of 207.20 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(2-fluorophenyl)-2,5-dihydropyrrole-1-carboxylic acid is sourced from PubChem (CID 151683948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 151683948 — identifiers, structure, computed properties (public domain)

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