3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine

C23H22ClN5O2 — CID 134434996

IUPAC3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine
SMILESCOc1cc(-c2ccc(N3CCC(Oc4ccccn4)CC3)nc2)c2c(Cl)cnn2c1
InChIInChI=1S/C23H22ClN5O2/c1-30-18-12-19(23-20(24)14-27-29(23)15-18)16-5-6-21(26-13-16)28-10-7-17(8-11-28)31-22-4-2-3-9-25-22/h2-6,9,12-15,17H,7-8,10-11H2,1H3
InChIKeyIRUUAUMWNYFYDN-UHFFFAOYSA-N
MW435.92 g/mol
LogP4.50
Rot. Bonds5

About 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine

3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine (PubChem CID 134434996) has the molecular formula C23H22ClN5O2 and a molecular weight of 435.92 g/mol. Its IUPAC name is 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine
PubChem CID134434996
Molecular FormulaC23H22ClN5O2
Molecular Weight435.92 g/mol
Exact Mass435.15
IUPAC Name3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine
SMILESCOc1cc(-c2ccc(N3CCC(Oc4ccccn4)CC3)nc2)c2c(Cl)cnn2c1
InChIInChI=1S/C23H22ClN5O2/c1-30-18-12-19(23-20(24)14-27-29(23)15-18)16-5-6-21(26-13-16)28-10-7-17(8-11-28)31-22-4-2-3-9-25-22/h2-6,9,12-15,17H,7-8,10-11H2,1H3
InChIKeyIRUUAUMWNYFYDN-UHFFFAOYSA-N
XLogP4.50
TPSA64.78 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.92
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

Selpercatinib
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4-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]morpholine
CID 56940772
4-[6-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]morpholine
CID 56942076
US10954240, Example 17
CID 118930219
3-[1-(2-Chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyrimidin-3-ylpyridin-2-amine
CID 146185133
3-[1-(2-Chloro-5-fluorophenyl)ethoxy]-5-pyrazolo[1,5-a]pyridin-3-ylpyridin-2-amine
CID 146185205
4-Chloro-6-[1-methyl-4-[[2-[2-(6-oxa-3-azabicyclo[3.1.1]heptan-3-yl)ethoxy]phenyl]methyl]pyrazol-3-yl]pyrimidin-2-amine
CID 166101838
[6-[6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-3-yl]methanamine
CID 89914582
3-(5-Chloro-4-methyl-3-pyridinyl)-1-methyl-6-(pyridin-2-ylmethoxy)pyrazolo[3,4-b]pyrazine
CID 76325410
4-[6-[6-(2-Fluoro-6-methoxyphenyl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]morpholine
CID 162648867
1-[4-Chloro-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-6-(2-fluoro-6-methoxyphenyl)pyrazolo[4,3-c]pyridine
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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine?
The IUPAC name of 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine (CID 134434996) is 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine is COc1cc(-c2ccc(N3CCC(Oc4ccccn4)CC3)nc2)c2c(Cl)cnn2c1.
What is the InChIKey of 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine?
The InChIKey is IRUUAUMWNYFYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22ClN5O2/c1-30-18-12-19(23-20(24)14-27-29(23)15-18)16-5-6-21(26-13-16)28-10-7-17(8-11-28)31-22-4-2-3-9-25-22/h2-6,9,12-15,17H,7-8,10-11H2,1H3.
What are the key properties of 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine?
3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine has a molecular weight of 435.92 g/mol, XLogP of 4.50, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-methoxy-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 134434996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).