2-Chloro-6-phenoxypyridine

C11H8ClNO — CID 817662

IUPAC2-chloro-6-phenoxypyridine
SMILESC1=CC=C(C=C1)OC2=NC(=CC=C2)Cl
InChIInChI=1S/C11H8ClNO/c12-10-7-4-8-11(13-10)14-9-5-2-1-3-6-9/h1-8H
InChIKeyFTBCXEHMCFPRRF-UHFFFAOYSA-N
MW205.64 g/mol
LogP3.70
Rot. Bonds2

About 2-Chloro-6-phenoxypyridine

2-Chloro-6-phenoxypyridine (PubChem CID 817662) has the molecular formula C11H8ClNO and a molecular weight of 205.64 g/mol. Its IUPAC name is 2-chloro-6-phenoxypyridine.

Molecular Properties

Compound Name2-Chloro-6-phenoxypyridine
PubChem CID817662
Molecular FormulaC11H8ClNO
Molecular Weight205.64 g/mol
Exact Mass205.03
IUPAC Name2-chloro-6-phenoxypyridine
SMILESC1=CC=C(C=C1)OC2=NC(=CC=C2)Cl
InChIInChI=1S/C11H8ClNO/c12-10-7-4-8-11(13-10)14-9-5-2-1-3-6-9/h1-8H
InChIKeyFTBCXEHMCFPRRF-UHFFFAOYSA-N
XLogP3.70
TPSA22.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity171

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.64
LogP ≤ 53.70
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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Related Compounds

2-Chloro-6-ethoxypyridine
CID 98563
2-(3-Chlorobenzyloxy)-6-chloroisonicotinonitrile
CID 44409846
2-Chloro-6-methoxypyridine
CID 87009
2-[3-(4-Chlorophenoxy)prop-1-yn-1-yl]-6-methylpyridine
CID 11345906
2-(3-(3,4-Dichlorophenoxy)prop-1-ynyl)-6-methylpyridine
CID 11358285
2-(3-(3-Chlorophenoxy)but-1-ynyl)-6-methylpyridine
CID 11737347
2-(3-(3-Chlorophenoxy)prop-1-ynyl)-6-methylpyridine
CID 44415963
5-Chloro-2-[(6-fluoro-2-pyridinyl)oxy]phenol
CID 69503784
2-Phenoxypyridine
CID 78510
2,6-Diphenoxypyridine
CID 824772
2-tert-Butoxy-6-chloropyridine
CID 11984350
3,6-Dichloro-2-[4-(3,6-dichloropyridin-2-yl)oxyphenoxy]pyridine
CID 2427302

Frequently Asked Questions

What is the IUPAC name of 2-Chloro-6-phenoxypyridine?
The IUPAC name of 2-Chloro-6-phenoxypyridine (CID 817662) is 2-chloro-6-phenoxypyridine.
What is the SMILES notation for 2-Chloro-6-phenoxypyridine?
The canonical SMILES for 2-Chloro-6-phenoxypyridine is C1=CC=C(C=C1)OC2=NC(=CC=C2)Cl.
What is the InChIKey of 2-Chloro-6-phenoxypyridine?
The InChIKey is FTBCXEHMCFPRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNO/c12-10-7-4-8-11(13-10)14-9-5-2-1-3-6-9/h1-8H.
What are the key properties of 2-Chloro-6-phenoxypyridine?
2-Chloro-6-phenoxypyridine has a molecular weight of 205.64 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Chloro-6-phenoxypyridine is sourced from PubChem (CID 817662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).