3-methyl-5-phenoxypyridine

C12H11NO — CID 12673490

IUPAC3-methyl-5-phenoxypyridine
SMILESCc1cncc(Oc2ccccc2)c1
InChIInChI=1S/C12H11NO/c1-10-7-12(9-13-8-10)14-11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyJSPLRPPLJGKXEQ-UHFFFAOYSA-N
MW185.23 g/mol
LogP3.18
Rot. Bonds2

About 3-methyl-5-phenoxypyridine

3-methyl-5-phenoxypyridine (PubChem CID 12673490) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is 3-methyl-5-phenoxypyridine.

Molecular Properties

Compound Name3-methyl-5-phenoxypyridine
PubChem CID12673490
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name3-methyl-5-phenoxypyridine
SMILESCc1cncc(Oc2ccccc2)c1
InChIInChI=1S/C12H11NO/c1-10-7-12(9-13-8-10)14-11-5-3-2-4-6-11/h2-9H,1H3
InChIKeyJSPLRPPLJGKXEQ-UHFFFAOYSA-N
XLogP3.18
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methyl-5-phenoxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenoxypyridine?
The IUPAC name of 3-methyl-5-phenoxypyridine (CID 12673490) is 3-methyl-5-phenoxypyridine.
What is the SMILES notation for 3-methyl-5-phenoxypyridine?
The canonical SMILES for 3-methyl-5-phenoxypyridine is Cc1cncc(Oc2ccccc2)c1.
What is the InChIKey of 3-methyl-5-phenoxypyridine?
The InChIKey is JSPLRPPLJGKXEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c1-10-7-12(9-13-8-10)14-11-5-3-2-4-6-11/h2-9H,1H3.
What are the key properties of 3-methyl-5-phenoxypyridine?
3-methyl-5-phenoxypyridine has a molecular weight of 185.23 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenoxypyridine is sourced from PubChem (CID 12673490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).