ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate

C16H14N2O2 — CID 46223052

IUPACethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate
SMILESCCOC(=O)c1ccn2nc(-c3ccccc3)cc2c1
InChIInChI=1S/C16H14N2O2/c1-2-20-16(19)13-8-9-18-14(10-13)11-15(17-18)12-6-4-3-5-7-12/h3-11H,2H2,1H3
InChIKeyIVFDZKZCRQQGLA-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.18
Rot. Bonds3

About ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate

ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate (PubChem CID 46223052) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate.

Molecular Properties

Compound Nameethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate
PubChem CID46223052
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Nameethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate
SMILESCCOC(=O)c1ccn2nc(-c3ccccc3)cc2c1
InChIInChI=1S/C16H14N2O2/c1-2-20-16(19)13-8-9-18-14(10-13)11-15(17-18)12-6-4-3-5-7-12/h3-11H,2H2,1H3
InChIKeyIVFDZKZCRQQGLA-UHFFFAOYSA-N
XLogP3.18
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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bicyclo[3.1.0]hexa-1(6),2,4-triene;ethyl benzoate
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ethyl 2-amino-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
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ethyl 2,6-diphenylpyrimidine-4-carboxylate
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ethyl 7-benzoylindolizine-2-carboxylate
CID 71386260
[2-(4-ethoxycarbonylanilino)-2-oxoethyl] 1,3-diphenylpyrazole-5-carboxylate
CID 3925529
ethyl 4-azulen-2-ylbenzoate
CID 122206706
ethyl 4-(2-amino-2-oxoethoxy)-2-phenylquinoline-6-carboxylate
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CID 158970570
CID 158970570

Frequently Asked Questions

What is the IUPAC name of ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate?
The IUPAC name of ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate (CID 46223052) is ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate.
What is the SMILES notation for ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate?
The canonical SMILES for ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate is CCOC(=O)c1ccn2nc(-c3ccccc3)cc2c1.
What is the InChIKey of ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate?
The InChIKey is IVFDZKZCRQQGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-2-20-16(19)13-8-9-18-14(10-13)11-15(17-18)12-6-4-3-5-7-12/h3-11H,2H2,1H3.
What are the key properties of ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate?
ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate has a molecular weight of 266.30 g/mol, XLogP of 3.18, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-phenylpyrazolo[1,5-a]pyridine-5-carboxylate is sourced from PubChem (CID 46223052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).