ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol

C32H36N6O4 — CID 159867281

IUPACethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol
SMILESCCOC(=O)c1c(CC)nn2ccccc12.CCc1nn2ccccc2c1C=O.CCc1nn2ccccc2c1CO
InChIInChI=1S/C12H14N2O2.C10H12N2O.C10H10N2O/c1-3-9-11(12(15)16-4-2)10-7-5-6-8-14(10)13-9;2*1-2-9-8(7-13)10-5-3-4-6-12(10)11-9/h5-8H,3-4H2,1-2H3;3-6,13H,2,7H2,1H3;3-7H,2H2,1H3
InChIKeyNRWVQFXNNSDUNV-UHFFFAOYSA-N
MW568.68 g/mol
LogP5.17
Rot. Bonds7

About ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol

ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol (PubChem CID 159867281) has the molecular formula C32H36N6O4 and a molecular weight of 568.68 g/mol. Its IUPAC name is ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol.

Molecular Properties

Compound Nameethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol
PubChem CID159867281
Molecular FormulaC32H36N6O4
Molecular Weight568.68 g/mol
Exact Mass568.28
IUPAC Nameethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol
SMILESCCOC(=O)c1c(CC)nn2ccccc12.CCc1nn2ccccc2c1C=O.CCc1nn2ccccc2c1CO
InChIInChI=1S/C12H14N2O2.C10H12N2O.C10H10N2O/c1-3-9-11(12(15)16-4-2)10-7-5-6-8-14(10)13-9;2*1-2-9-8(7-13)10-5-3-4-6-12(10)11-9/h5-8H,3-4H2,1-2H3;3-6,13H,2,7H2,1H3;3-7H,2H2,1H3
InChIKeyNRWVQFXNNSDUNV-UHFFFAOYSA-N
XLogP5.17
TPSA115.50 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500568.68
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Pyrazolo[1,5-a]pyridine-3-carboxylic acid 8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester
CID 19770958
Cyclohexyl 2-pyridin-4-ylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 137634765
Cyclohexyl 2-phenylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 137642480
Butyl 2-phenylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 137658202
Ethyl 2-(4-fluorophenyl)pyrazolo[1,5-A]pyridine-3-carboxylate
CID 71284143
Ethyl 2-pyridin-4-ylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 102503342
Ethyl 2-(4-methoxycarbonylphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 137636784
Cyclohexyl 2-(4-methoxycarbonylphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 137640554
Ethyl 2-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 137641288
Ethyl 2-(4-phenylphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 137646934
Ethyl 2-pyridin-3-ylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 137647742
Tert-butyl 2-phenylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 137649489

Frequently Asked Questions

What is the IUPAC name of ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol?
The IUPAC name of ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol (CID 159867281) is ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol.
What is the SMILES notation for ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol?
The canonical SMILES for ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol is CCOC(=O)c1c(CC)nn2ccccc12.CCc1nn2ccccc2c1C=O.CCc1nn2ccccc2c1CO.
What is the InChIKey of ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol?
The InChIKey is NRWVQFXNNSDUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2.C10H12N2O.C10H10N2O/c1-3-9-11(12(15)16-4-2)10-7-5-6-8-14(10)13-9;2*1-2-9-8(7-13)10-5-3-4-6-12(10)11-9/h5-8H,3-4H2,1-2H3;3-6,13H,2,7H2,1H3;3-7H,2H2,1H3.
What are the key properties of ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol?
ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol has a molecular weight of 568.68 g/mol, XLogP of 5.17, 7 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-ethylpyrazolo[1,5-a]pyridine-3-carboxylate;2-ethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;(2-ethylpyrazolo[1,5-a]pyridin-3-yl)methanol is sourced from PubChem (CID 159867281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).