ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate

C17H16N2O3 — CID 144559581

IUPACethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(-c2ccc(OC)cc2)nn2ccccc12
InChIInChI=1S/C17H16N2O3/c1-3-22-17(20)15-14-6-4-5-11-19(14)18-16(15)12-7-9-13(21-2)10-8-12/h4-11H,3H2,1-2H3
InChIKeyQVTFUDVIQSXMRJ-UHFFFAOYSA-N
MW296.33 g/mol
LogP3.19
Rot. Bonds4

About ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate

ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 144559581) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
PubChem CID144559581
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Nameethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(-c2ccc(OC)cc2)nn2ccccc12
InChIInChI=1S/C17H16N2O3/c1-3-22-17(20)15-14-6-4-5-11-19(14)18-16(15)12-7-9-13(21-2)10-8-12/h4-11H,3H2,1-2H3
InChIKeyQVTFUDVIQSXMRJ-UHFFFAOYSA-N
XLogP3.19
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate (CID 144559581) is ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate is CCOC(=O)c1c(-c2ccc(OC)cc2)nn2ccccc12.
What is the InChIKey of ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
The InChIKey is QVTFUDVIQSXMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-3-22-17(20)15-14-6-4-5-11-19(14)18-16(15)12-7-9-13(21-2)10-8-12/h4-11H,3H2,1-2H3.
What are the key properties of ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 296.33 g/mol, XLogP of 3.19, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 144559581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).