3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine

C23H21N7 — CID 137112914

IUPAC3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
SMILESc1cc(N2CCCCC2)c2cc(-c3n[nH]c4cnc(-c5cnccn5)cc34)[nH]c2c1
InChIInChI=1S/C23H21N7/c1-2-9-30(10-3-1)22-6-4-5-17-15(22)11-19(27-17)23-16-12-18(21-13-24-7-8-25-21)26-14-20(16)28-29-23/h4-8,11-14,27H,1-3,9-10H2,(H,28,29)
InChIKeyMQWLFBATFFGNJY-UHFFFAOYSA-N
MW395.47 g/mol
LogP4.55
Rot. Bonds3

About 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine

3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine (PubChem CID 137112914) has the molecular formula C23H21N7 and a molecular weight of 395.47 g/mol. Its IUPAC name is 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
PubChem CID137112914
Molecular FormulaC23H21N7
Molecular Weight395.47 g/mol
Exact Mass395.19
IUPAC Name3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
SMILESc1cc(N2CCCCC2)c2cc(-c3n[nH]c4cnc(-c5cnccn5)cc34)[nH]c2c1
InChIInChI=1S/C23H21N7/c1-2-9-30(10-3-1)22-6-4-5-17-15(22)11-19(27-17)23-16-12-18(21-13-24-7-8-25-21)26-14-20(16)28-29-23/h4-8,11-14,27H,1-3,9-10H2,(H,28,29)
InChIKeyMQWLFBATFFGNJY-UHFFFAOYSA-N
XLogP4.55
TPSA86.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.47
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-piperidin-1-yl-1H-indol-2-yl)-5-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137113468
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridine
CID 137114479
5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137115913
3-[4-(4-methylpiperazin-1-yl)-1H-indol-2-yl]-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
CID 137113296
5-(4-methyl-3-pyridinyl)-3-(4-piperidin-1-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137111185
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole
CID 137115804
5-(4-methyl-3-pyridinyl)-3-(4-piperidin-1-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137034121
N-[5-[3-[4-(4-methylpiperazin-1-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]cyclopropanecarboxamide
CID 137112904
3-(4-piperidin-1-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
CID 138603218
5-(5-methoxy-3-pyridinyl)-3-(4-piperidin-1-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137033318
N,N-dimethyl-2-[[5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]oxy]ethanamine
CID 137310744
3-(4-piperidin-1-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
CID 137311576

Frequently Asked Questions

What is the IUPAC name of 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine (CID 137112914) is 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine is c1cc(N2CCCCC2)c2cc(-c3n[nH]c4cnc(-c5cnccn5)cc34)[nH]c2c1.
What is the InChIKey of 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is MQWLFBATFFGNJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N7/c1-2-9-30(10-3-1)22-6-4-5-17-15(22)11-19(27-17)23-16-12-18(21-13-24-7-8-25-21)26-14-20(16)28-29-23/h4-8,11-14,27H,1-3,9-10H2,(H,28,29).
What are the key properties of 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine?
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 395.47 g/mol, XLogP of 4.55, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 137112914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).