6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C27H27N7O3 — CID 134435148

IUPAC6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1cnn2cc(OCCN3CCOCC3)cc(-c3ccc(N4CC(Oc5ccccn5)C4)nc3)c12
InChIInChI=1S/C27H27N7O3/c28-14-21-16-31-34-19-22(36-12-9-32-7-10-35-11-8-32)13-24(27(21)34)20-4-5-25(30-15-20)33-17-23(18-33)37-26-3-1-2-6-29-26/h1-6,13,15-16,19,23H,7-12,17-18H2
InChIKeyOVHWYRAWXFIHIY-UHFFFAOYSA-N
MW497.56 g/mol
LogP2.64
Rot. Bonds8

About 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 134435148) has the molecular formula C27H27N7O3 and a molecular weight of 497.56 g/mol. Its IUPAC name is 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID134435148
Molecular FormulaC27H27N7O3
Molecular Weight497.56 g/mol
Exact Mass497.22
IUPAC Name6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1cnn2cc(OCCN3CCOCC3)cc(-c3ccc(N4CC(Oc5ccccn5)C4)nc3)c12
InChIInChI=1S/C27H27N7O3/c28-14-21-16-31-34-19-22(36-12-9-32-7-10-35-11-8-32)13-24(27(21)34)20-4-5-25(30-15-20)33-17-23(18-33)37-26-3-1-2-6-29-26/h1-6,13,15-16,19,23H,7-12,17-18H2
InChIKeyOVHWYRAWXFIHIY-UHFFFAOYSA-N
XLogP2.64
TPSA101.04 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500497.56
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Related Compounds

6-(2-methoxyethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134435407
6-[(4-methylmorpholin-2-yl)methoxy]-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134436394
4-[6-(3-amino-4-pyridin-2-yloxypyrrolidin-1-yl)-3-pyridinyl]-6-ethoxypyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134435370
4-[6-[(3S,4R)-3-amino-4-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]-6-ethoxypyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134435368
4-[6-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)-3-pyridinyl]-6-(2-morpholin-4-ylethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 167679021
4-[6-(1,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-6-(2-morpholin-4-ylethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile;dihydrochloride
CID 134496096
4-[6-[3-[(6-methoxy-3-pyridinyl)oxy]azetidin-1-yl]-3-pyridinyl]-6-[2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)ethoxy]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 162353646
2-[3-cyano-4-[6-(4-pyridin-2-yloxypiperidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-N,N-dimethylacetamide
CID 134435867
1-[5-[3-cyano-6-(2-morpholin-4-ylethoxy)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-4-methyl-N-[(2S)-3-methylbutan-2-yl]piperidine-4-carboxamide;sulfane
CID 162083005
4-[6-(3,6-diazabicyclo[3.1.1]heptan-3-yl)-3-pyridinyl]-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134435413
6-ethoxy-4-[6-[4-(3-morpholin-4-yl-2-oxopropyl)-4-(pyridin-2-ylmethyl)piperidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 148808569
6-(2-hydroxy-2-methylpropoxy)-4-[6-[3-[[6-(trifluoromethyl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134496783

Frequently Asked Questions

What is the IUPAC name of 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 134435148) is 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is N#Cc1cnn2cc(OCCN3CCOCC3)cc(-c3ccc(N4CC(Oc5ccccn5)C4)nc3)c12.
What is the InChIKey of 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is OVHWYRAWXFIHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27N7O3/c28-14-21-16-31-34-19-22(36-12-9-32-7-10-35-11-8-32)13-24(27(21)34)20-4-5-25(30-15-20)33-17-23(18-33)37-26-3-1-2-6-29-26/h1-6,13,15-16,19,23H,7-12,17-18H2.
What are the key properties of 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 497.56 g/mol, XLogP of 2.64, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-morpholin-4-ylethoxy)-4-[6-(3-pyridin-2-yloxyazetidin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 134435148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).