ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate

C10H11N3O2 — CID 118987364

IUPACethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate
SMILESCCOC(=O)c1nccc2cn(C)nc12
InChIInChI=1S/C10H11N3O2/c1-3-15-10(14)9-8-7(4-5-11-9)6-13(2)12-8/h4-6H,3H2,1-2H3
InChIKeyYHYAVTOIYXMVGE-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.14
Rot. Bonds2

About ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate

ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate (PubChem CID 118987364) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate.

Molecular Properties

Compound Nameethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate
PubChem CID118987364
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Nameethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate
SMILESCCOC(=O)c1nccc2cn(C)nc12
InChIInChI=1S/C10H11N3O2/c1-3-15-10(14)9-8-7(4-5-11-9)6-13(2)12-8/h4-6H,3H2,1-2H3
InChIKeyYHYAVTOIYXMVGE-UHFFFAOYSA-N
XLogP1.14
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methylpyrazolo[3,4-c]pyridine-7-carboxamide
CID 163404734
ethyl 6-hydroxyisoquinoline-1-carboxylate
CID 136951521
ethyl 5-chloro-2-methylpyrazolo[4,3-b]pyridine-7-carboxylate
CID 169206457
ethyl 1,5-dimethylimidazole-4-carboxylate
CID 13143714
ethyl 3-aminopyridine-2-carboxylate
CID 565054
ethyl 3-bromopyrazine-2-carboxylate
CID 91884522
ethyl 3-fluoropyridine-2-carboxylate
CID 46311381
ethane;ethyl 3-aminopyridine-2-carboxylate
CID 143635646
ethyl 5-(1-methylimidazol-4-yl)-2H-triazole-4-carboxylate
CID 165462445
ethyl 4-amino-1-(2-hydroxyethyl)pyrazole-3-carboxylate
CID 107344782
ethyl 4-amino-1-(4-methoxypyrimidin-2-yl)pyrazole-3-carboxylate
CID 107346852
ethyl 5-(4-fluorophenyl)-1-methyl-4-oxopyridazine-3-carboxylate
CID 175918303

Frequently Asked Questions

What is the IUPAC name of ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate?
The IUPAC name of ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate (CID 118987364) is ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate.
What is the SMILES notation for ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate?
The canonical SMILES for ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate is CCOC(=O)c1nccc2cn(C)nc12.
What is the InChIKey of ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate?
The InChIKey is YHYAVTOIYXMVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-3-15-10(14)9-8-7(4-5-11-9)6-13(2)12-8/h4-6H,3H2,1-2H3.
What are the key properties of ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate?
ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate has a molecular weight of 205.22 g/mol, XLogP of 1.14, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-methylpyrazolo[3,4-c]pyridine-7-carboxylate is sourced from PubChem (CID 118987364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).