1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one

C18H20N4O — CID 137413545

IUPAC1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one
SMILESCC(C)C(=O)c1cnn2c(C3CC3)c(-c3cnn(C)c3)ccc12
InChIInChI=1S/C18H20N4O/c1-11(2)18(23)15-9-20-22-16(15)7-6-14(17(22)12-4-5-12)13-8-19-21(3)10-13/h6-12H,4-5H2,1-3H3
InChIKeyZVZUFMIBIURAQK-UHFFFAOYSA-N
MW308.39 g/mol
LogP3.45
Rot. Bonds4

About 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one

1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one (PubChem CID 137413545) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one.

Molecular Properties

Compound Name1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one
PubChem CID137413545
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC Name1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one
SMILESCC(C)C(=O)c1cnn2c(C3CC3)c(-c3cnn(C)c3)ccc12
InChIInChI=1S/C18H20N4O/c1-11(2)18(23)15-9-20-22-16(15)7-6-14(17(22)12-4-5-12)13-8-19-21(3)10-13/h6-12H,4-5H2,1-3H3
InChIKeyZVZUFMIBIURAQK-UHFFFAOYSA-N
XLogP3.45
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one?
The IUPAC name of 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one (CID 137413545) is 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one.
What is the SMILES notation for 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one?
The canonical SMILES for 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one is CC(C)C(=O)c1cnn2c(C3CC3)c(-c3cnn(C)c3)ccc12.
What is the InChIKey of 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one?
The InChIKey is ZVZUFMIBIURAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-11(2)18(23)15-9-20-22-16(15)7-6-14(17(22)12-4-5-12)13-8-19-21(3)10-13/h6-12H,4-5H2,1-3H3.
What are the key properties of 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one?
1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one has a molecular weight of 308.39 g/mol, XLogP of 3.45, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[7-cyclopropyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-methylpropan-1-one is sourced from PubChem (CID 137413545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).