1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone

C17H18N4O2 — CID 118674967

IUPAC1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone
SMILESCC(=O)c1cnn2cc(-c3cnn(C4CCOCC4)c3)ccc12
InChIInChI=1S/C17H18N4O2/c1-12(22)16-9-19-21-10-13(2-3-17(16)21)14-8-18-20(11-14)15-4-6-23-7-5-15/h2-3,8-11,15H,4-7H2,1H3
InChIKeyMVOPASWOGDDZIN-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.75
Rot. Bonds3

About 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone

1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone (PubChem CID 118674967) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone.

Molecular Properties

Compound Name1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone
PubChem CID118674967
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone
SMILESCC(=O)c1cnn2cc(-c3cnn(C4CCOCC4)c3)ccc12
InChIInChI=1S/C17H18N4O2/c1-12(22)16-9-19-21-10-13(2-3-17(16)21)14-8-18-20(11-14)15-4-6-23-7-5-15/h2-3,8-11,15H,4-7H2,1H3
InChIKeyMVOPASWOGDDZIN-UHFFFAOYSA-N
XLogP2.75
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone?
The IUPAC name of 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone (CID 118674967) is 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone.
What is the SMILES notation for 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone?
The canonical SMILES for 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone is CC(=O)c1cnn2cc(-c3cnn(C4CCOCC4)c3)ccc12.
What is the InChIKey of 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone?
The InChIKey is MVOPASWOGDDZIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-12(22)16-9-19-21-10-13(2-3-17(16)21)14-8-18-20(11-14)15-4-6-23-7-5-15/h2-3,8-11,15H,4-7H2,1H3.
What are the key properties of 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone?
1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone has a molecular weight of 310.36 g/mol, XLogP of 2.75, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[1-(oxan-4-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyridin-3-yl]ethanone is sourced from PubChem (CID 118674967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).