5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole

C21H19FN6O — CID 67960267

IUPAC5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
SMILESFc1cncc(-c2ccc3[nH]nc(-c4cncc(OC5CCCNC5)n4)c3c2)c1
InChIInChI=1S/C21H19FN6O/c22-15-6-14(8-24-9-15)13-3-4-18-17(7-13)21(28-27-18)19-11-25-12-20(26-19)29-16-2-1-5-23-10-16/h3-4,6-9,11-12,16,23H,1-2,5,10H2,(H,27,28)
InChIKeyNVPFWRMNVMNXHD-UHFFFAOYSA-N
MW390.42 g/mol
LogP3.35
Rot. Bonds4

About 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole

5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole (PubChem CID 67960267) has the molecular formula C21H19FN6O and a molecular weight of 390.42 g/mol. Its IUPAC name is 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole.

Molecular Properties

Compound Name5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
PubChem CID67960267
Molecular FormulaC21H19FN6O
Molecular Weight390.42 g/mol
Exact Mass390.16
IUPAC Name5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
SMILESFc1cncc(-c2ccc3[nH]nc(-c4cncc(OC5CCCNC5)n4)c3c2)c1
InChIInChI=1S/C21H19FN6O/c22-15-6-14(8-24-9-15)13-3-4-18-17(7-13)21(28-27-18)19-11-25-12-20(26-19)29-16-2-1-5-23-10-16/h3-4,6-9,11-12,16,23H,1-2,5,10H2,(H,27,28)
InChIKeyNVPFWRMNVMNXHD-UHFFFAOYSA-N
XLogP3.35
TPSA88.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.42
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-phenyl-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
CID 67960084
5-(2,6-difluorophenyl)-3-[6-[(3R)-piperidin-3-yl]oxypyrazin-2-yl]-1H-indazole
CID 67959597
3-(6-piperidin-3-yloxypyrazin-2-yl)-5-pyridazin-3-yl-1H-indazole
CID 67960106
5-(6-methoxy-2-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole
CID 67960019
3-(6-piperidin-3-yloxypyrazin-2-yl)-5-(2-propan-2-yloxypyrimidin-4-yl)-1H-indazole
CID 67959774
5-(2,6-difluorophenyl)-3-[6-[(3S,4S)-4-methylpiperidin-3-yl]oxypyrazin-2-yl]-1H-indazole
CID 67959616
3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-(4-fluoro-3-pyridinyl)-1H-indazole
CID 118725607
5-(2,6-difluorophenyl)-3-[6-[(3R)-4,4-dimethylpiperidin-3-yl]oxypyrazin-2-yl]-1H-indazole
CID 67959780
3-[6-[[(8R)-5-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-(6-cyclopropylpyrazin-2-yl)-1H-indazole
CID 57384133
3-[3-[6-[[(8R)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-1H-indazol-5-yl]-N-cyclopropylbenzamide
CID 67960606
7-(4-fluorophenyl)-2-[5-(5-piperidin-4-yloxy-3-pyridinyl)-1H-indazol-3-yl]-1H-imidazo[4,5-b]pyridine
CID 136938075
5-(2-chloro-6-fluorophenyl)-3-[6-[(3R)-piperidin-3-yl]oxypyrazin-2-yl]-1H-indole;bis(2,2,2-trifluoroacetic acid)
CID 86709771

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole?
The IUPAC name of 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole (CID 67960267) is 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole.
What is the SMILES notation for 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole?
The canonical SMILES for 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole is Fc1cncc(-c2ccc3[nH]nc(-c4cncc(OC5CCCNC5)n4)c3c2)c1.
What is the InChIKey of 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole?
The InChIKey is NVPFWRMNVMNXHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN6O/c22-15-6-14(8-24-9-15)13-3-4-18-17(7-13)21(28-27-18)19-11-25-12-20(26-19)29-16-2-1-5-23-10-16/h3-4,6-9,11-12,16,23H,1-2,5,10H2,(H,27,28).
What are the key properties of 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole?
5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole has a molecular weight of 390.42 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-3-pyridinyl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indazole is sourced from PubChem (CID 67960267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).