2-[(6-methylpiperidin-3-yl)methyl]pyrazine

C11H17N3 — CID 104823559

IUPAC2-[(6-methylpiperidin-3-yl)methyl]pyrazine
SMILESCC1CCC(Cc2cnccn2)CN1
InChIInChI=1S/C11H17N3/c1-9-2-3-10(7-14-9)6-11-8-12-4-5-13-11/h4-5,8-10,14H,2-3,6-7H2,1H3
InChIKeyLHHGZIINHZSIEQ-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.41
Rot. Bonds2

About 2-[(6-methylpiperidin-3-yl)methyl]pyrazine

2-[(6-methylpiperidin-3-yl)methyl]pyrazine (PubChem CID 104823559) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-[(6-methylpiperidin-3-yl)methyl]pyrazine.

Molecular Properties

Compound Name2-[(6-methylpiperidin-3-yl)methyl]pyrazine
PubChem CID104823559
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-[(6-methylpiperidin-3-yl)methyl]pyrazine
SMILESCC1CCC(Cc2cnccn2)CN1
InChIInChI=1S/C11H17N3/c1-9-2-3-10(7-14-9)6-11-8-12-4-5-13-11/h4-5,8-10,14H,2-3,6-7H2,1H3
InChIKeyLHHGZIINHZSIEQ-UHFFFAOYSA-N
XLogP1.41
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-methylpiperidin-3-yl)methyl]pyrazine?
The IUPAC name of 2-[(6-methylpiperidin-3-yl)methyl]pyrazine (CID 104823559) is 2-[(6-methylpiperidin-3-yl)methyl]pyrazine.
What is the SMILES notation for 2-[(6-methylpiperidin-3-yl)methyl]pyrazine?
The canonical SMILES for 2-[(6-methylpiperidin-3-yl)methyl]pyrazine is CC1CCC(Cc2cnccn2)CN1.
What is the InChIKey of 2-[(6-methylpiperidin-3-yl)methyl]pyrazine?
The InChIKey is LHHGZIINHZSIEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-2-3-10(7-14-9)6-11-8-12-4-5-13-11/h4-5,8-10,14H,2-3,6-7H2,1H3.
What are the key properties of 2-[(6-methylpiperidin-3-yl)methyl]pyrazine?
2-[(6-methylpiperidin-3-yl)methyl]pyrazine has a molecular weight of 191.28 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methylpiperidin-3-yl)methyl]pyrazine is sourced from PubChem (CID 104823559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).