1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol

C17H19N5O — CID 162653960

IUPAC1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol
SMILESCc1[nH]nc2ccc(-c3cncc(N4CCC(O)CC4)n3)cc12
InChIInChI=1S/C17H19N5O/c1-11-14-8-12(2-3-15(14)21-20-11)16-9-18-10-17(19-16)22-6-4-13(23)5-7-22/h2-3,8-10,13,23H,4-7H2,1H3,(H,20,21)
InChIKeyFWNGIOZXEPPEBU-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.29
Rot. Bonds2

About 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol

1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol (PubChem CID 162653960) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol
PubChem CID162653960
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol
SMILESCc1[nH]nc2ccc(-c3cncc(N4CCC(O)CC4)n3)cc12
InChIInChI=1S/C17H19N5O/c1-11-14-8-12(2-3-15(14)21-20-11)16-9-18-10-17(19-16)22-6-4-13(23)5-7-22/h2-3,8-10,13,23H,4-7H2,1H3,(H,20,21)
InChIKeyFWNGIOZXEPPEBU-UHFFFAOYSA-N
XLogP2.29
TPSA77.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol?
The IUPAC name of 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol (CID 162653960) is 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol.
What is the SMILES notation for 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol?
The canonical SMILES for 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol is Cc1[nH]nc2ccc(-c3cncc(N4CCC(O)CC4)n3)cc12.
What is the InChIKey of 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol?
The InChIKey is FWNGIOZXEPPEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c1-11-14-8-12(2-3-15(14)21-20-11)16-9-18-10-17(19-16)22-6-4-13(23)5-7-22/h2-3,8-10,13,23H,4-7H2,1H3,(H,20,21).
What are the key properties of 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol?
1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol has a molecular weight of 309.37 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]piperidin-4-ol is sourced from PubChem (CID 162653960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).