5-(2,6-dimethylphenoxy)-2-phenylpyridine

C19H17NO — CID 168848324

IUPAC5-(2,6-dimethylphenoxy)-2-phenylpyridine
SMILESCc1cccc(C)c1Oc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C19H17NO/c1-14-7-6-8-15(2)19(14)21-17-11-12-18(20-13-17)16-9-4-3-5-10-16/h3-13H,1-2H3
InChIKeyDFSMXHQFINJJQA-UHFFFAOYSA-N
MW275.35 g/mol
LogP5.16
Rot. Bonds3

About 5-(2,6-dimethylphenoxy)-2-phenylpyridine

5-(2,6-dimethylphenoxy)-2-phenylpyridine (PubChem CID 168848324) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 5-(2,6-dimethylphenoxy)-2-phenylpyridine.

Molecular Properties

Compound Name5-(2,6-dimethylphenoxy)-2-phenylpyridine
PubChem CID168848324
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name5-(2,6-dimethylphenoxy)-2-phenylpyridine
SMILESCc1cccc(C)c1Oc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C19H17NO/c1-14-7-6-8-15(2)19(14)21-17-11-12-18(20-13-17)16-9-4-3-5-10-16/h3-13H,1-2H3
InChIKeyDFSMXHQFINJJQA-UHFFFAOYSA-N
XLogP5.16
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.35
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethylphenoxy)-2-phenylpyridine?
The IUPAC name of 5-(2,6-dimethylphenoxy)-2-phenylpyridine (CID 168848324) is 5-(2,6-dimethylphenoxy)-2-phenylpyridine.
What is the SMILES notation for 5-(2,6-dimethylphenoxy)-2-phenylpyridine?
The canonical SMILES for 5-(2,6-dimethylphenoxy)-2-phenylpyridine is Cc1cccc(C)c1Oc1ccc(-c2ccccc2)nc1.
What is the InChIKey of 5-(2,6-dimethylphenoxy)-2-phenylpyridine?
The InChIKey is DFSMXHQFINJJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c1-14-7-6-8-15(2)19(14)21-17-11-12-18(20-13-17)16-9-4-3-5-10-16/h3-13H,1-2H3.
What are the key properties of 5-(2,6-dimethylphenoxy)-2-phenylpyridine?
5-(2,6-dimethylphenoxy)-2-phenylpyridine has a molecular weight of 275.35 g/mol, XLogP of 5.16, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethylphenoxy)-2-phenylpyridine is sourced from PubChem (CID 168848324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).