[2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone

C21H15FN2O — CID 134851462

IUPAC[2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone
SMILESCc1cccn2nc(-c3ccc(F)cc3)c(C(=O)c3ccccc3)c12
InChIInChI=1S/C21H15FN2O/c1-14-6-5-13-24-20(14)18(21(25)16-7-3-2-4-8-16)19(23-24)15-9-11-17(22)12-10-15/h2-13H,1H3
InChIKeyICSNPERWPOZRAL-UHFFFAOYSA-N
MW330.36 g/mol
LogP4.68
Rot. Bonds3

About [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone

[2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone (PubChem CID 134851462) has the molecular formula C21H15FN2O and a molecular weight of 330.36 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone
PubChem CID134851462
Molecular FormulaC21H15FN2O
Molecular Weight330.36 g/mol
Exact Mass330.12
IUPAC Name[2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone
SMILESCc1cccn2nc(-c3ccc(F)cc3)c(C(=O)c3ccccc3)c12
InChIInChI=1S/C21H15FN2O/c1-14-6-5-13-24-20(14)18(21(25)16-7-3-2-4-8-16)19(23-24)15-9-11-17(22)12-10-15/h2-13H,1H3
InChIKeyICSNPERWPOZRAL-UHFFFAOYSA-N
XLogP4.68
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone?
The IUPAC name of [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone (CID 134851462) is [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone.
What is the SMILES notation for [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone?
The canonical SMILES for [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone is Cc1cccn2nc(-c3ccc(F)cc3)c(C(=O)c3ccccc3)c12.
What is the InChIKey of [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone?
The InChIKey is ICSNPERWPOZRAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN2O/c1-14-6-5-13-24-20(14)18(21(25)16-7-3-2-4-8-16)19(23-24)15-9-11-17(22)12-10-15/h2-13H,1H3.
What are the key properties of [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone?
[2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone has a molecular weight of 330.36 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-4-methylpyrazolo[1,5-a]pyridin-3-yl]-phenylmethanone is sourced from PubChem (CID 134851462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).