1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid

C10H7FN2O2 — CID 175768383

IUPAC1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid
SMILESO=C(O)c1cccn1-c1ccc(F)cn1
InChIInChI=1S/C10H7FN2O2/c11-7-3-4-9(12-6-7)13-5-1-2-8(13)10(14)15/h1-6H,(H,14,15)
InChIKeyCZXMPXGXHLGZBR-UHFFFAOYSA-N
MW206.18 g/mol
LogP1.71
Rot. Bonds2

About 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid

1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid (PubChem CID 175768383) has the molecular formula C10H7FN2O2 and a molecular weight of 206.18 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid
PubChem CID175768383
Molecular FormulaC10H7FN2O2
Molecular Weight206.18 g/mol
Exact Mass206.05
IUPAC Name1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid
SMILESO=C(O)c1cccn1-c1ccc(F)cn1
InChIInChI=1S/C10H7FN2O2/c11-7-3-4-9(12-6-7)13-5-1-2-8(13)10(14)15/h1-6H,(H,14,15)
InChIKeyCZXMPXGXHLGZBR-UHFFFAOYSA-N
XLogP1.71
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Phenylpyrrole-2-carboxylic acid
CID 227455
2-(2,5-Dimethylpyrrol-1-yl)pyridine-3-carboxylic acid
CID 63653569
6-(1H-imidazol-1-yl)pyridazine-3-carboxylic acid
CID 6416392
4-(1H-imidazol-1-yl)pyridine-2-carboxylic acid
CID 26967237
2-(1H-pyrrol-1-yl)pyridine-3-carboxylic acid
CID 63653570
1-Vinyl-1H-pyrrole-2-carboxylic acid
CID 586189
1-(4-fluorophenyl)-1H-pyrrole-2-carboxylic acid
CID 17390044
Imidazo(1,2-a)pyridine-5-carboxylic acid
CID 18983819
6-(1H-imidazol-1-yl)pyridine-2-carboxylic acid
CID 28875514
Pyrrolo(1,2-a)pyrimidine-6-carboxylic acid
CID 45356733
6-(1H-pyrazol-1-yl)pyridine-2-carboxylic acid
CID 54594501
Imidazo(1,2-a)pyridine-5-carboxylic acid hydrochloride
CID 56737688

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid (CID 175768383) is 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid is O=C(O)c1cccn1-c1ccc(F)cn1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid?
The InChIKey is CZXMPXGXHLGZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O2/c11-7-3-4-9(12-6-7)13-5-1-2-8(13)10(14)15/h1-6H,(H,14,15).
What are the key properties of 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid?
1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid has a molecular weight of 206.18 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)pyrrole-2-carboxylic acid is sourced from PubChem (CID 175768383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).