3-(2,3-dimethylphenyl)-4,5-dimethylpyridine

C15H17N — CID 146588490

IUPAC3-(2,3-dimethylphenyl)-4,5-dimethylpyridine
SMILESCc1cccc(-c2cncc(C)c2C)c1C
InChIInChI=1S/C15H17N/c1-10-6-5-7-14(12(10)3)15-9-16-8-11(2)13(15)4/h5-9H,1-4H3
InChIKeyGTEFMHQPMKBNTM-UHFFFAOYSA-N
MW211.31 g/mol
LogP3.98
Rot. Bonds1

About 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine

3-(2,3-dimethylphenyl)-4,5-dimethylpyridine (PubChem CID 146588490) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine.

Molecular Properties

Compound Name3-(2,3-dimethylphenyl)-4,5-dimethylpyridine
PubChem CID146588490
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name3-(2,3-dimethylphenyl)-4,5-dimethylpyridine
SMILESCc1cccc(-c2cncc(C)c2C)c1C
InChIInChI=1S/C15H17N/c1-10-6-5-7-14(12(10)3)15-9-16-8-11(2)13(15)4/h5-9H,1-4H3
InChIKeyGTEFMHQPMKBNTM-UHFFFAOYSA-N
XLogP3.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine?
The IUPAC name of 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine (CID 146588490) is 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine.
What is the SMILES notation for 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine?
The canonical SMILES for 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine is Cc1cccc(-c2cncc(C)c2C)c1C.
What is the InChIKey of 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine?
The InChIKey is GTEFMHQPMKBNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N/c1-10-6-5-7-14(12(10)3)15-9-16-8-11(2)13(15)4/h5-9H,1-4H3.
What are the key properties of 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine?
3-(2,3-dimethylphenyl)-4,5-dimethylpyridine has a molecular weight of 211.31 g/mol, XLogP of 3.98, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylphenyl)-4,5-dimethylpyridine is sourced from PubChem (CID 146588490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).