6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid

C10H11FN2O2 — CID 122057812

IUPAC6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCC(F)C2)n1
InChIInChI=1S/C10H11FN2O2/c11-7-4-5-13(6-7)9-3-1-2-8(12-9)10(14)15/h1-3,7H,4-6H2,(H,14,15)
InChIKeyQRTMJLVOPBUTSL-UHFFFAOYSA-N
MW210.21 g/mol
LogP1.33
Rot. Bonds2

About 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid

6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid (PubChem CID 122057812) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid
PubChem CID122057812
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCC(F)C2)n1
InChIInChI=1S/C10H11FN2O2/c11-7-4-5-13(6-7)9-3-1-2-8(12-9)10(14)15/h1-3,7H,4-6H2,(H,14,15)
InChIKeyQRTMJLVOPBUTSL-UHFFFAOYSA-N
XLogP1.33
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridine-2-carboxylic acid
CID 63537874
6-[3-(4-fluorophenyl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 122057093
6-(3-hydroxyazetidin-1-yl)pyridine-2-carboxylic acid
CID 83830615
6-(4-tert-butylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 55053326
6-(3-cyclopropylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 122057511
6-[3-(oxan-4-yl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 122054567
6-(4-propan-2-ylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 103496539
6-(4-carbamoylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 55053558
6-(3,5-dimethylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 62254825
6-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridine-2-carboxylic acid
CID 122054919
6-[(3S,4S)-3-carboxy-4-(trifluoromethyl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 122063960
6-[3-(2,2,2-trifluoro-1-hydroxyethyl)piperidin-1-yl]pyridine-2-carboxylic acid
CID 122051931

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid (CID 122057812) is 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid is O=C(O)c1cccc(N2CCC(F)C2)n1.
What is the InChIKey of 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid?
The InChIKey is QRTMJLVOPBUTSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c11-7-4-5-13(6-7)9-3-1-2-8(12-9)10(14)15/h1-3,7H,4-6H2,(H,14,15).
What are the key properties of 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid?
6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid has a molecular weight of 210.21 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 122057812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).