3-Phenoxypyridine

C11H9NO — CID 200510

IUPAC3-phenoxypyridine
SMILESC1=CC=C(C=C1)OC2=CN=CC=C2
InChIInChI=1S/C11H9NO/c1-2-5-10(6-3-1)13-11-7-4-8-12-9-11/h1-9H
InChIKeyKDGUIKPOZGYLQJ-UHFFFAOYSA-N
MW171.19 g/mol
LogP2.50
Rot. Bonds2

About 3-Phenoxypyridine

3-Phenoxypyridine (PubChem CID 200510) has the molecular formula C11H9NO and a molecular weight of 171.19 g/mol. Its IUPAC name is 3-phenoxypyridine.

Molecular Properties

Compound Name3-Phenoxypyridine
PubChem CID200510
Molecular FormulaC11H9NO
Molecular Weight171.19 g/mol
Exact Mass171.07
IUPAC Name3-phenoxypyridine
SMILESC1=CC=C(C=C1)OC2=CN=CC=C2
InChIInChI=1S/C11H9NO/c1-2-5-10(6-3-1)13-11-7-4-8-12-9-11/h1-9H
InChIKeyKDGUIKPOZGYLQJ-UHFFFAOYSA-N
XLogP2.50
TPSA22.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity143

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.19
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-Phenoxypyridine?
The IUPAC name of 3-Phenoxypyridine (CID 200510) is 3-phenoxypyridine.
What is the SMILES notation for 3-Phenoxypyridine?
The canonical SMILES for 3-Phenoxypyridine is C1=CC=C(C=C1)OC2=CN=CC=C2.
What is the InChIKey of 3-Phenoxypyridine?
The InChIKey is KDGUIKPOZGYLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO/c1-2-5-10(6-3-1)13-11-7-4-8-12-9-11/h1-9H.
What are the key properties of 3-Phenoxypyridine?
3-Phenoxypyridine has a molecular weight of 171.19 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-Phenoxypyridine is sourced from PubChem (CID 200510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).