1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone

C20H15N3O — CID 15158135

IUPAC1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone
SMILESCC(=O)c1cnccc1-c1c(-c2ccccc2)nn2ccccc12
InChIInChI=1S/C20H15N3O/c1-14(24)17-13-21-11-10-16(17)19-18-9-5-6-12-23(18)22-20(19)15-7-3-2-4-8-15/h2-13H,1H3
InChIKeyZWFHYDOMCZSUJR-UHFFFAOYSA-N
MW313.36 g/mol
LogP4.27
Rot. Bonds3

About 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone

1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone (PubChem CID 15158135) has the molecular formula C20H15N3O and a molecular weight of 313.36 g/mol. Its IUPAC name is 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone.

Molecular Properties

Compound Name1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone
PubChem CID15158135
Molecular FormulaC20H15N3O
Molecular Weight313.36 g/mol
Exact Mass313.12
IUPAC Name1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone
SMILESCC(=O)c1cnccc1-c1c(-c2ccccc2)nn2ccccc12
InChIInChI=1S/C20H15N3O/c1-14(24)17-13-21-11-10-16(17)19-18-9-5-6-12-23(18)22-20(19)15-7-3-2-4-8-15/h2-13H,1H3
InChIKeyZWFHYDOMCZSUJR-UHFFFAOYSA-N
XLogP4.27
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone?
The IUPAC name of 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone (CID 15158135) is 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone.
What is the SMILES notation for 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone?
The canonical SMILES for 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone is CC(=O)c1cnccc1-c1c(-c2ccccc2)nn2ccccc12.
What is the InChIKey of 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone?
The InChIKey is ZWFHYDOMCZSUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O/c1-14(24)17-13-21-11-10-16(17)19-18-9-5-6-12-23(18)22-20(19)15-7-3-2-4-8-15/h2-13H,1H3.
What are the key properties of 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone?
1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone has a molecular weight of 313.36 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-3-pyridinyl]ethanone is sourced from PubChem (CID 15158135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).