4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine

C23H21FN4O — CID 21027422

IUPAC4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine
SMILESFc1ccc(-c2nn3c(CN4CCOCC4)cccc3c2-c2ccncc2)cc1
InChIInChI=1S/C23H21FN4O/c24-19-6-4-18(5-7-19)23-22(17-8-10-25-11-9-17)21-3-1-2-20(28(21)26-23)16-27-12-14-29-15-13-27/h1-11H,12-16H2
InChIKeyQXVPRGBDSYVTJE-UHFFFAOYSA-N
MW388.45 g/mol
LogP4.03
Rot. Bonds4

About 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine

4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine (PubChem CID 21027422) has the molecular formula C23H21FN4O and a molecular weight of 388.45 g/mol. Its IUPAC name is 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine
PubChem CID21027422
Molecular FormulaC23H21FN4O
Molecular Weight388.45 g/mol
Exact Mass388.17
IUPAC Name4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine
SMILESFc1ccc(-c2nn3c(CN4CCOCC4)cccc3c2-c2ccncc2)cc1
InChIInChI=1S/C23H21FN4O/c24-19-6-4-18(5-7-19)23-22(17-8-10-25-11-9-17)21-3-1-2-20(28(21)26-23)16-27-12-14-29-15-13-27/h1-11H,12-16H2
InChIKeyQXVPRGBDSYVTJE-UHFFFAOYSA-N
XLogP4.03
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine?
The IUPAC name of 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine (CID 21027422) is 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine.
What is the SMILES notation for 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine?
The canonical SMILES for 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine is Fc1ccc(-c2nn3c(CN4CCOCC4)cccc3c2-c2ccncc2)cc1.
What is the InChIKey of 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine?
The InChIKey is QXVPRGBDSYVTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN4O/c24-19-6-4-18(5-7-19)23-22(17-8-10-25-11-9-17)21-3-1-2-20(28(21)26-23)16-27-12-14-29-15-13-27/h1-11H,12-16H2.
What are the key properties of 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine?
4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine has a molecular weight of 388.45 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methyl]morpholine is sourced from PubChem (CID 21027422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).