5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid

C12H9FN4O2 — CID 58505866

IUPAC5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid
SMILESCn1nc(C(=O)O)cc1-c1cn2cc(F)ccc2n1
InChIInChI=1S/C12H9FN4O2/c1-16-10(4-8(15-16)12(18)19)9-6-17-5-7(13)2-3-11(17)14-9/h2-6H,1H3,(H,18,19)
InChIKeyNMEJKSIZGXPOEL-UHFFFAOYSA-N
MW260.23 g/mol
LogP1.57
Rot. Bonds2

About 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid

5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid (PubChem CID 58505866) has the molecular formula C12H9FN4O2 and a molecular weight of 260.23 g/mol. Its IUPAC name is 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid.

Molecular Properties

Compound Name5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid
PubChem CID58505866
Molecular FormulaC12H9FN4O2
Molecular Weight260.23 g/mol
Exact Mass260.07
IUPAC Name5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid
SMILESCn1nc(C(=O)O)cc1-c1cn2cc(F)ccc2n1
InChIInChI=1S/C12H9FN4O2/c1-16-10(4-8(15-16)12(18)19)9-6-17-5-7(13)2-3-11(17)14-9/h2-6H,1H3,(H,18,19)
InChIKeyNMEJKSIZGXPOEL-UHFFFAOYSA-N
XLogP1.57
TPSA72.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid?
The IUPAC name of 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid (CID 58505866) is 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid.
What is the SMILES notation for 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid?
The canonical SMILES for 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid is Cn1nc(C(=O)O)cc1-c1cn2cc(F)ccc2n1.
What is the InChIKey of 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid?
The InChIKey is NMEJKSIZGXPOEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN4O2/c1-16-10(4-8(15-16)12(18)19)9-6-17-5-7(13)2-3-11(17)14-9/h2-6H,1H3,(H,18,19).
What are the key properties of 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid?
5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid has a molecular weight of 260.23 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methylpyrazole-3-carboxylic acid is sourced from PubChem (CID 58505866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).