6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane

C17H23N — CID 176948420

IUPAC6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane
SMILESCC.Cc1ccc(-c2ccc(C)c(C)n2)c(C)c1
InChIInChI=1S/C15H17N.C2H6/c1-10-5-7-14(12(3)9-10)15-8-6-11(2)13(4)16-15;1-2/h5-9H,1-4H3;1-2H3
InChIKeyYTUVUAADADFDTO-UHFFFAOYSA-N
MW241.38 g/mol
LogP5.01
Rot. Bonds1

About 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane

6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane (PubChem CID 176948420) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane.

Molecular Properties

Compound Name6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane
PubChem CID176948420
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane
SMILESCC.Cc1ccc(-c2ccc(C)c(C)n2)c(C)c1
InChIInChI=1S/C15H17N.C2H6/c1-10-5-7-14(12(3)9-10)15-8-6-11(2)13(4)16-15;1-2/h5-9H,1-4H3;1-2H3
InChIKeyYTUVUAADADFDTO-UHFFFAOYSA-N
XLogP5.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500241.38
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane?
The IUPAC name of 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane (CID 176948420) is 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane.
What is the SMILES notation for 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane?
The canonical SMILES for 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane is CC.Cc1ccc(-c2ccc(C)c(C)n2)c(C)c1.
What is the InChIKey of 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane?
The InChIKey is YTUVUAADADFDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N.C2H6/c1-10-5-7-14(12(3)9-10)15-8-6-11(2)13(4)16-15;1-2/h5-9H,1-4H3;1-2H3.
What are the key properties of 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane?
6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane has a molecular weight of 241.38 g/mol, XLogP of 5.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane is sourced from PubChem (CID 176948420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).