ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate

C10H11N3O3 — CID 139542716

IUPACethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate
SMILESCCOC(=O)c1cc(OC)nc2[nH]ncc12
InChIInChI=1S/C10H11N3O3/c1-3-16-10(14)6-4-8(15-2)12-9-7(6)5-11-13-9/h4-5H,3H2,1-2H3,(H,11,12,13)
InChIKeyBPTCURSIUYQCEC-UHFFFAOYSA-N
MW221.22 g/mol
LogP1.14
Rot. Bonds3

About ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate

ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate (PubChem CID 139542716) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate.

Molecular Properties

Compound Nameethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate
PubChem CID139542716
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Nameethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate
SMILESCCOC(=O)c1cc(OC)nc2[nH]ncc12
InChIInChI=1S/C10H11N3O3/c1-3-16-10(14)6-4-8(15-2)12-9-7(6)5-11-13-9/h4-5H,3H2,1-2H3,(H,11,12,13)
InChIKeyBPTCURSIUYQCEC-UHFFFAOYSA-N
XLogP1.14
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 6-pyrrolidin-1-yl-1H-pyrazolo[5,4-b]pyridine-4-carboxylate
CID 166306315
ethyl 6-(4-bromophenyl)-1H-pyrazolo[5,4-b]pyridine-4-carboxylate
CID 68787287
ethyl 4-methoxy-5-methyl-1H-indazole-7-carboxylate
CID 170744696
ethyl 6-[(3S)-3-(2-hydroxyethyl)pyrrolidin-1-yl]-1H-pyrazolo[5,4-b]pyridine-4-carboxylate
CID 166307085
ethyl 3-(difluoromethyl)-2-iodo-6-methoxypyridine-4-carboxylate
CID 133101862
ethyl 4-(4-methoxycarbonylphenyl)-1H-pyrazolo[5,4-b]pyridine-6-carboxylate
CID 155684775
ethyl 6-oxo-1,7-dihydropyrazolo[5,4-b]pyridine-5-carboxylate
CID 154729406
ethyl 4-chloro-6-[(4-methoxyphenyl)methyl]-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
CID 123563964
4-ethoxycarbonyl-1H-pyrazole-5-carboxylic acid
CID 19599802
ethyl 3-(aminomethyl)-2-(difluoromethyl)-6-methoxypyridine-4-carboxylate
CID 133085086
ethyl 5-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylate
CID 3426999
ethyl 5-(1-methoxyethyl)-1H-pyrazole-4-carboxylate
CID 86692037

Frequently Asked Questions

What is the IUPAC name of ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate?
The IUPAC name of ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate (CID 139542716) is ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate.
What is the SMILES notation for ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate?
The canonical SMILES for ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate is CCOC(=O)c1cc(OC)nc2[nH]ncc12.
What is the InChIKey of ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate?
The InChIKey is BPTCURSIUYQCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c1-3-16-10(14)6-4-8(15-2)12-9-7(6)5-11-13-9/h4-5H,3H2,1-2H3,(H,11,12,13).
What are the key properties of ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate?
ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate has a molecular weight of 221.22 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-methoxy-1H-pyrazolo[5,4-b]pyridine-4-carboxylate is sourced from PubChem (CID 139542716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).