3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol

C13H17N3O2 — CID 171465891

IUPAC3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol
SMILESCCc1nn(C2CCCCO2)c2ncc(O)cc12
InChIInChI=1S/C13H17N3O2/c1-2-11-10-7-9(17)8-14-13(10)16(15-11)12-5-3-4-6-18-12/h7-8,12,17H,2-6H2,1H3
InChIKeyMNMPDMGRHRSAME-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.40
Rot. Bonds2

About 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol

3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol (PubChem CID 171465891) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol.

Molecular Properties

Compound Name3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol
PubChem CID171465891
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol
SMILESCCc1nn(C2CCCCO2)c2ncc(O)cc12
InChIInChI=1S/C13H17N3O2/c1-2-11-10-7-9(17)8-14-13(10)16(15-11)12-5-3-4-6-18-12/h7-8,12,17H,2-6H2,1H3
InChIKeyMNMPDMGRHRSAME-UHFFFAOYSA-N
XLogP2.40
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[5,4-b]pyridine
CID 121228950
3-(chloromethyl)-6-methyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridine
CID 143866443
5-bromo-3-[4-(3-methyl-2-pyridinyl)phenyl]-1-(oxan-2-yl)pyrazolo[5,4-b]pyridine
CID 170545992
1-(oxan-2-yl)-3-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine
CID 171465867
3-bromo-1-(oxan-2-yl)pyrazolo[5,4-b]pyridine
CID 91663938
3-chloro-1-(oxan-2-yl)pyrazolo[3,4-d]pyrimidine
CID 141132128
5-bromo-N-methoxy-N-methyl-1-(oxan-2-yl)pyrazolo[5,4-b]pyridine-3-carboxamide
CID 58378019
3-iodo-5-methyl-1-[(2R)-oxan-2-yl]pyrazolo[3,4-b]pyrazine
CID 125418917
3-chloro-5-methyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine
CID 118988228
3-methyl-4-(1-methylpiperidin-4-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol
CID 171465859
6-chloro-3-(cyclopropylmethyl)-1-(oxan-2-yl)pyrazolo[4,3-c]pyridine
CID 170351982
6-ethyl-1-(oxan-2-yl)indazol-4-amine
CID 175161622

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol?
The IUPAC name of 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol (CID 171465891) is 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol.
What is the SMILES notation for 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol?
The canonical SMILES for 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol is CCc1nn(C2CCCCO2)c2ncc(O)cc12.
What is the InChIKey of 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol?
The InChIKey is MNMPDMGRHRSAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-2-11-10-7-9(17)8-14-13(10)16(15-11)12-5-3-4-6-18-12/h7-8,12,17H,2-6H2,1H3.
What are the key properties of 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol?
3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol has a molecular weight of 247.30 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol is sourced from PubChem (CID 171465891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).