6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol

C21H21N5O — CID 168977895

IUPAC6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol
SMILESCn1cc2cc(-c3ccc4nc(C5CCNCC5)ccc4c3O)ncc2n1
InChIInChI=1S/C21H21N5O/c1-26-12-14-10-19(23-11-20(14)25-26)16-3-5-18-15(21(16)27)2-4-17(24-18)13-6-8-22-9-7-13/h2-5,10-13,22,27H,6-9H2,1H3
InChIKeyPOUXNVGLPJXZGY-UHFFFAOYSA-N
MW359.43 g/mol
LogP3.36
Rot. Bonds2

About 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol

6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol (PubChem CID 168977895) has the molecular formula C21H21N5O and a molecular weight of 359.43 g/mol. Its IUPAC name is 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol.

Molecular Properties

Compound Name6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol
PubChem CID168977895
Molecular FormulaC21H21N5O
Molecular Weight359.43 g/mol
Exact Mass359.17
IUPAC Name6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol
SMILESCn1cc2cc(-c3ccc4nc(C5CCNCC5)ccc4c3O)ncc2n1
InChIInChI=1S/C21H21N5O/c1-26-12-14-10-19(23-11-20(14)25-26)16-3-5-18-15(21(16)27)2-4-17(24-18)13-6-8-22-9-7-13/h2-5,10-13,22,27H,6-9H2,1H3
InChIKeyPOUXNVGLPJXZGY-UHFFFAOYSA-N
XLogP3.36
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(2-methylindazol-5-yl)-7-piperidin-4-ylquinazolin-4-one
CID 156889049
5-[6-(1-ethylpiperidin-4-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 162433617
6-(1-ethylpiperidin-4-yl)-2-(2-methylindazol-5-yl)quinoline;2-(2-methylindazol-5-yl)-6-piperidin-4-ylquinoline;6-(2-methylindazol-5-yl)-2-piperidin-4-ylquinoline
CID 157096267
7-fluoro-5-[6-[(3S,4S)-3-hydroxypiperidin-4-yl]-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 170008953
7-fluoro-5-[6-(3-hydroxypiperidin-4-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 168976923
8-(2,7-dimethylindazol-5-yl)-6-fluoro-2-piperidin-4-ylquinoline
CID 174159605
2-methyl-5-[6-[(3S)-pyrrolidin-3-yl]oxy-1,8-naphthyridin-2-yl]indazol-6-ol
CID 170011837
7-(2,7-dimethylindazol-5-yl)-3-piperidin-4-ylisoquinoline;6-(2,7-dimethylindazol-5-yl)-2-piperidin-4-ylquinoxaline
CID 161237062
2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
CID 156888108
5-(2-methylindazol-5-yl)-2-piperidin-4-yl-6H-[1,3]thiazolo[5,4-d]pyrimidin-7-one
CID 156888736
2-methyl-5-(6-piperazin-1-yl-1,5-naphthyridin-2-yl)indazol-6-ol
CID 162433567
5-[(2-methylpropan-2-yl)oxy]-2-piperidin-4-ylquinoline
CID 18365263

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol?
The IUPAC name of 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol (CID 168977895) is 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol.
What is the SMILES notation for 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol?
The canonical SMILES for 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol is Cn1cc2cc(-c3ccc4nc(C5CCNCC5)ccc4c3O)ncc2n1.
What is the InChIKey of 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol?
The InChIKey is POUXNVGLPJXZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N5O/c1-26-12-14-10-19(23-11-20(14)25-26)16-3-5-18-15(21(16)27)2-4-17(24-18)13-6-8-22-9-7-13/h2-5,10-13,22,27H,6-9H2,1H3.
What are the key properties of 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol?
6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol has a molecular weight of 359.43 g/mol, XLogP of 3.36, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylpyrazolo[3,4-c]pyridin-5-yl)-2-piperidin-4-ylquinolin-5-ol is sourced from PubChem (CID 168977895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).