2-chloro-5-methyl-4-phenoxypyridine

C12H10ClNO — CID 83269011

IUPAC2-chloro-5-methyl-4-phenoxypyridine
SMILESCc1cnc(Cl)cc1Oc1ccccc1
InChIInChI=1S/C12H10ClNO/c1-9-8-14-12(13)7-11(9)15-10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyFOMVNMNRTYOVHR-UHFFFAOYSA-N
MW219.67 g/mol
LogP3.84
Rot. Bonds2

About 2-chloro-5-methyl-4-phenoxypyridine

2-chloro-5-methyl-4-phenoxypyridine (PubChem CID 83269011) has the molecular formula C12H10ClNO and a molecular weight of 219.67 g/mol. Its IUPAC name is 2-chloro-5-methyl-4-phenoxypyridine.

Molecular Properties

Compound Name2-chloro-5-methyl-4-phenoxypyridine
PubChem CID83269011
Molecular FormulaC12H10ClNO
Molecular Weight219.67 g/mol
Exact Mass219.05
IUPAC Name2-chloro-5-methyl-4-phenoxypyridine
SMILESCc1cnc(Cl)cc1Oc1ccccc1
InChIInChI=1S/C12H10ClNO/c1-9-8-14-12(13)7-11(9)15-10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyFOMVNMNRTYOVHR-UHFFFAOYSA-N
XLogP3.84
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.67
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-methyl-4-phenoxypyridine?
The IUPAC name of 2-chloro-5-methyl-4-phenoxypyridine (CID 83269011) is 2-chloro-5-methyl-4-phenoxypyridine.
What is the SMILES notation for 2-chloro-5-methyl-4-phenoxypyridine?
The canonical SMILES for 2-chloro-5-methyl-4-phenoxypyridine is Cc1cnc(Cl)cc1Oc1ccccc1.
What is the InChIKey of 2-chloro-5-methyl-4-phenoxypyridine?
The InChIKey is FOMVNMNRTYOVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO/c1-9-8-14-12(13)7-11(9)15-10-5-3-2-4-6-10/h2-8H,1H3.
What are the key properties of 2-chloro-5-methyl-4-phenoxypyridine?
2-chloro-5-methyl-4-phenoxypyridine has a molecular weight of 219.67 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-methyl-4-phenoxypyridine is sourced from PubChem (CID 83269011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).