2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine

C16H20N4O — CID 126874169

IUPAC2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine
SMILESCc1cncc(N2CCC(COc3ccccn3)CC2)n1
InChIInChI=1S/C16H20N4O/c1-13-10-17-11-15(19-13)20-8-5-14(6-9-20)12-21-16-4-2-3-7-18-16/h2-4,7,10-11,14H,5-6,8-9,12H2,1H3
InChIKeyIAQDPWFRVKPWCM-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.48
Rot. Bonds4

About 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine

2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine (PubChem CID 126874169) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine.

Molecular Properties

Compound Name2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine
PubChem CID126874169
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine
SMILESCc1cncc(N2CCC(COc3ccccn3)CC2)n1
InChIInChI=1S/C16H20N4O/c1-13-10-17-11-15(19-13)20-8-5-14(6-9-20)12-21-16-4-2-3-7-18-16/h2-4,7,10-11,14H,5-6,8-9,12H2,1H3
InChIKeyIAQDPWFRVKPWCM-UHFFFAOYSA-N
XLogP2.48
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine?
The IUPAC name of 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine (CID 126874169) is 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine.
What is the SMILES notation for 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine?
The canonical SMILES for 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine is Cc1cncc(N2CCC(COc3ccccn3)CC2)n1.
What is the InChIKey of 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine?
The InChIKey is IAQDPWFRVKPWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-13-10-17-11-15(19-13)20-8-5-14(6-9-20)12-21-16-4-2-3-7-18-16/h2-4,7,10-11,14H,5-6,8-9,12H2,1H3.
What are the key properties of 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine?
2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine has a molecular weight of 284.36 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine is sourced from PubChem (CID 126874169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).