4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine

C21H20FN5O — CID 58033252

IUPAC4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine
SMILESFc1ccc(-c2cc(-c3nc(CN4CCOCC4)c4ccccn34)[nH]n2)cc1
InChIInChI=1S/C21H20FN5O/c22-16-6-4-15(5-7-16)17-13-18(25-24-17)21-23-19(14-26-9-11-28-12-10-26)20-3-1-2-8-27(20)21/h1-8,13H,9-12,14H2,(H,24,25)
InChIKeyCJABDWHSLGAONT-UHFFFAOYSA-N
MW377.42 g/mol
LogP3.36
Rot. Bonds4

About 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine

4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine (PubChem CID 58033252) has the molecular formula C21H20FN5O and a molecular weight of 377.42 g/mol. Its IUPAC name is 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine
PubChem CID58033252
Molecular FormulaC21H20FN5O
Molecular Weight377.42 g/mol
Exact Mass377.17
IUPAC Name4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine
SMILESFc1ccc(-c2cc(-c3nc(CN4CCOCC4)c4ccccn34)[nH]n2)cc1
InChIInChI=1S/C21H20FN5O/c22-16-6-4-15(5-7-16)17-13-18(25-24-17)21-23-19(14-26-9-11-28-12-10-26)20-3-1-2-8-27(20)21/h1-8,13H,9-12,14H2,(H,24,25)
InChIKeyCJABDWHSLGAONT-UHFFFAOYSA-N
XLogP3.36
TPSA58.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine?
The IUPAC name of 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine (CID 58033252) is 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine.
What is the SMILES notation for 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine?
The canonical SMILES for 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine is Fc1ccc(-c2cc(-c3nc(CN4CCOCC4)c4ccccn34)[nH]n2)cc1.
What is the InChIKey of 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine?
The InChIKey is CJABDWHSLGAONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN5O/c22-16-6-4-15(5-7-16)17-13-18(25-24-17)21-23-19(14-26-9-11-28-12-10-26)20-3-1-2-8-27(20)21/h1-8,13H,9-12,14H2,(H,24,25).
What are the key properties of 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine?
4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine has a molecular weight of 377.42 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]imidazo[1,5-a]pyridin-1-yl]methyl]morpholine is sourced from PubChem (CID 58033252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).