6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine

C12H15N3 — CID 58105064

IUPAC6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine
SMILESCCc1ccc(-n2cnc(C)c2)c(C)n1
InChIInChI=1S/C12H15N3/c1-4-11-5-6-12(10(3)14-11)15-7-9(2)13-8-15/h5-8H,4H2,1-3H3
InChIKeyJIZXDLLDKUWNNL-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.45
Rot. Bonds2

About 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine

6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine (PubChem CID 58105064) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine.

Molecular Properties

Compound Name6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine
PubChem CID58105064
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine
SMILESCCc1ccc(-n2cnc(C)c2)c(C)n1
InChIInChI=1S/C12H15N3/c1-4-11-5-6-12(10(3)14-11)15-7-9(2)13-8-15/h5-8H,4H2,1-3H3
InChIKeyJIZXDLLDKUWNNL-UHFFFAOYSA-N
XLogP2.45
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine?
The IUPAC name of 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine (CID 58105064) is 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine.
What is the SMILES notation for 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine?
The canonical SMILES for 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine is CCc1ccc(-n2cnc(C)c2)c(C)n1.
What is the InChIKey of 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine?
The InChIKey is JIZXDLLDKUWNNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-4-11-5-6-12(10(3)14-11)15-7-9(2)13-8-15/h5-8H,4H2,1-3H3.
What are the key properties of 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine?
6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine has a molecular weight of 201.27 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-3-(4-methylimidazol-1-yl)pyridine is sourced from PubChem (CID 58105064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).