2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine

C20H26N4O2 — CID 58547959

IUPAC2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine
SMILESCc1cccnc1N1CCC(Oc2nccnc2C2CCOCC2)CC1
InChIInChI=1S/C20H26N4O2/c1-15-3-2-8-22-19(15)24-11-4-17(5-12-24)26-20-18(21-9-10-23-20)16-6-13-25-14-7-16/h2-3,8-10,16-17H,4-7,11-14H2,1H3
InChIKeyGKYKBZJRRJXNFF-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.12
Rot. Bonds4

About 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine

2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine (PubChem CID 58547959) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine.

Molecular Properties

Compound Name2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine
PubChem CID58547959
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine
SMILESCc1cccnc1N1CCC(Oc2nccnc2C2CCOCC2)CC1
InChIInChI=1S/C20H26N4O2/c1-15-3-2-8-22-19(15)24-11-4-17(5-12-24)26-20-18(21-9-10-23-20)16-6-13-25-14-7-16/h2-3,8-10,16-17H,4-7,11-14H2,1H3
InChIKeyGKYKBZJRRJXNFF-UHFFFAOYSA-N
XLogP3.12
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine?
The IUPAC name of 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine (CID 58547959) is 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine.
What is the SMILES notation for 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine?
The canonical SMILES for 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine is Cc1cccnc1N1CCC(Oc2nccnc2C2CCOCC2)CC1.
What is the InChIKey of 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine?
The InChIKey is GKYKBZJRRJXNFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-15-3-2-8-22-19(15)24-11-4-17(5-12-24)26-20-18(21-9-10-23-20)16-6-13-25-14-7-16/h2-3,8-10,16-17H,4-7,11-14H2,1H3.
What are the key properties of 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine?
2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine has a molecular weight of 354.45 g/mol, XLogP of 3.12, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-methyl-2-pyridinyl)piperidin-4-yl]oxy-3-(oxan-4-yl)pyrazine is sourced from PubChem (CID 58547959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).