1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine

C19H21N7 — CID 167943942

IUPAC1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine
SMILESCN1CCC(n2ncc3cc(-c4cnc5c(cnn5C)c4)cnc32)CC1
InChIInChI=1S/C19H21N7/c1-24-5-3-17(4-6-24)26-19-16(12-23-26)8-14(10-21-19)13-7-15-11-22-25(2)18(15)20-9-13/h7-12,17H,3-6H2,1-2H3
InChIKeyMLDBPQKRIWNTMT-UHFFFAOYSA-N
MW347.43 g/mol
LogP2.65
Rot. Bonds2

About 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine

1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine (PubChem CID 167943942) has the molecular formula C19H21N7 and a molecular weight of 347.43 g/mol. Its IUPAC name is 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine
PubChem CID167943942
Molecular FormulaC19H21N7
Molecular Weight347.43 g/mol
Exact Mass347.19
IUPAC Name1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine
SMILESCN1CCC(n2ncc3cc(-c4cnc5c(cnn5C)c4)cnc32)CC1
InChIInChI=1S/C19H21N7/c1-24-5-3-17(4-6-24)26-19-16(12-23-26)8-14(10-21-19)13-7-15-11-22-25(2)18(15)20-9-13/h7-12,17H,3-6H2,1-2H3
InChIKeyMLDBPQKRIWNTMT-UHFFFAOYSA-N
XLogP2.65
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine with MolForge

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Related Compounds

6-methyl-1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridine-5-carboxylic acid
CID 43329014
4-(1-methylpyrazolo[3,4-b]pyridin-5-yl)phenol
CID 139537130
1-methyl-5-pyridin-3-ylpyrazolo[3,4-b]pyridine
CID 70543936
4-N-[6-(1-methylpyrazolo[3,4-b]pyridin-5-yl)pyrazin-2-yl]cyclohexane-1,4-diamine
CID 166300721
N-[[1-(1-ethylpiperidin-4-yl)pyrazolo[5,4-b]pyridin-5-yl]methyl]ethanamine
CID 63772055
[4-(1-methylpyrazolo[3,4-b]pyridin-5-yl)phenyl]-piperidin-3-ylmethanol
CID 167893520
1-(1-methylpiperidin-4-yl)-6-(1,2,4-triazol-4-yl)indazole;dihydrochloride
CID 18796586
1-(thian-4-yl)pyrazolo[3,4-b]pyridin-5-amine
CID 115040304
1-methyl-5-pyrimidin-4-ylpyrazolo[3,4-b]pyridine
CID 141403325
tert-butyl 4-(5-bromopyrazolo[3,4-b]pyridin-1-yl)piperidine-1-carboxylate
CID 167328407
1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 141059458
N-(cyclopropylmethyl)-1-methylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 166220823

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine?
The IUPAC name of 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine (CID 167943942) is 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine?
The canonical SMILES for 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine is CN1CCC(n2ncc3cc(-c4cnc5c(cnn5C)c4)cnc32)CC1.
What is the InChIKey of 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine?
The InChIKey is MLDBPQKRIWNTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7/c1-24-5-3-17(4-6-24)26-19-16(12-23-26)8-14(10-21-19)13-7-15-11-22-25(2)18(15)20-9-13/h7-12,17H,3-6H2,1-2H3.
What are the key properties of 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine?
1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine has a molecular weight of 347.43 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[1-(1-methylpiperidin-4-yl)pyrazolo[3,4-b]pyridin-5-yl]pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 167943942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).