2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine

C16H20N2 — CID 170279057

IUPAC2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine
SMILESCCc1c(C)cccc1-c1cnc(C(C)C)cn1
InChIInChI=1S/C16H20N2/c1-5-13-12(4)7-6-8-14(13)16-10-17-15(9-18-16)11(2)3/h6-11H,5H2,1-4H3
InChIKeyJLYHFPZOBBXQCC-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.14
Rot. Bonds3

About 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine

2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine (PubChem CID 170279057) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine.

Molecular Properties

Compound Name2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine
PubChem CID170279057
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine
SMILESCCc1c(C)cccc1-c1cnc(C(C)C)cn1
InChIInChI=1S/C16H20N2/c1-5-13-12(4)7-6-8-14(13)16-10-17-15(9-18-16)11(2)3/h6-11H,5H2,1-4H3
InChIKeyJLYHFPZOBBXQCC-UHFFFAOYSA-N
XLogP4.14
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine?
The IUPAC name of 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine (CID 170279057) is 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine.
What is the SMILES notation for 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine?
The canonical SMILES for 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine is CCc1c(C)cccc1-c1cnc(C(C)C)cn1.
What is the InChIKey of 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine?
The InChIKey is JLYHFPZOBBXQCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-5-13-12(4)7-6-8-14(13)16-10-17-15(9-18-16)11(2)3/h6-11H,5H2,1-4H3.
What are the key properties of 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine?
2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine has a molecular weight of 240.35 g/mol, XLogP of 4.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-3-methylphenyl)-5-propan-2-ylpyrazine is sourced from PubChem (CID 170279057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).