2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine

C12H19N3O — CID 102954494

IUPAC2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine
SMILESCc1cnc(C)c(OC2CNCCC2C)n1
InChIInChI=1S/C12H19N3O/c1-8-4-5-13-7-11(8)16-12-10(3)14-6-9(2)15-12/h6,8,11,13H,4-5,7H2,1-3H3
InChIKeyFLVRXNRYWFYVBF-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.47
Rot. Bonds2

About 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine

2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine (PubChem CID 102954494) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine.

Molecular Properties

Compound Name2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine
PubChem CID102954494
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine
SMILESCc1cnc(C)c(OC2CNCCC2C)n1
InChIInChI=1S/C12H19N3O/c1-8-4-5-13-7-11(8)16-12-10(3)14-6-9(2)15-12/h6,8,11,13H,4-5,7H2,1-3H3
InChIKeyFLVRXNRYWFYVBF-UHFFFAOYSA-N
XLogP1.47
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine?
The IUPAC name of 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine (CID 102954494) is 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine.
What is the SMILES notation for 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine?
The canonical SMILES for 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine is Cc1cnc(C)c(OC2CNCCC2C)n1.
What is the InChIKey of 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine?
The InChIKey is FLVRXNRYWFYVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8-4-5-13-7-11(8)16-12-10(3)14-6-9(2)15-12/h6,8,11,13H,4-5,7H2,1-3H3.
What are the key properties of 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine?
2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine has a molecular weight of 221.30 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-(4-methylpiperidin-3-yl)oxypyrazine is sourced from PubChem (CID 102954494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).