1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one

C12H14N2O2 — CID 118564456

IUPAC1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one
SMILESCOc1ccc2c(C(=O)C(C)C)cnn2c1
InChIInChI=1S/C12H14N2O2/c1-8(2)12(15)10-6-13-14-7-9(16-3)4-5-11(10)14/h4-8H,1-3H3
InChIKeyGUKJXAPYQXSFHH-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.18
Rot. Bonds3

About 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one

1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one (PubChem CID 118564456) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one.

Molecular Properties

Compound Name1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one
PubChem CID118564456
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one
SMILESCOc1ccc2c(C(=O)C(C)C)cnn2c1
InChIInChI=1S/C12H14N2O2/c1-8(2)12(15)10-6-13-14-7-9(16-3)4-5-11(10)14/h4-8H,1-3H3
InChIKeyGUKJXAPYQXSFHH-UHFFFAOYSA-N
XLogP2.18
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one?
The IUPAC name of 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one (CID 118564456) is 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one.
What is the SMILES notation for 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one?
The canonical SMILES for 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one is COc1ccc2c(C(=O)C(C)C)cnn2c1.
What is the InChIKey of 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one?
The InChIKey is GUKJXAPYQXSFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8(2)12(15)10-6-13-14-7-9(16-3)4-5-11(10)14/h4-8H,1-3H3.
What are the key properties of 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one?
1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one has a molecular weight of 218.26 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one is sourced from PubChem (CID 118564456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).