2-(2,3-dichlorophenyl)-3-methoxypyridine

C12H9Cl2NO — CID 90122655

IUPAC2-(2,3-dichlorophenyl)-3-methoxypyridine
SMILESCOc1cccnc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C12H9Cl2NO/c1-16-10-6-3-7-15-12(10)8-4-2-5-9(13)11(8)14/h2-7H,1H3
InChIKeyNZBUVWSVHUUQPD-UHFFFAOYSA-N
MW254.12 g/mol
LogP4.06
Rot. Bonds2

About 2-(2,3-dichlorophenyl)-3-methoxypyridine

2-(2,3-dichlorophenyl)-3-methoxypyridine (PubChem CID 90122655) has the molecular formula C12H9Cl2NO and a molecular weight of 254.12 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-3-methoxypyridine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-3-methoxypyridine
PubChem CID90122655
Molecular FormulaC12H9Cl2NO
Molecular Weight254.12 g/mol
Exact Mass253.01
IUPAC Name2-(2,3-dichlorophenyl)-3-methoxypyridine
SMILESCOc1cccnc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C12H9Cl2NO/c1-16-10-6-3-7-15-12(10)8-4-2-5-9(13)11(8)14/h2-7H,1H3
InChIKeyNZBUVWSVHUUQPD-UHFFFAOYSA-N
XLogP4.06
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.12
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-3-methoxypyridine?
The IUPAC name of 2-(2,3-dichlorophenyl)-3-methoxypyridine (CID 90122655) is 2-(2,3-dichlorophenyl)-3-methoxypyridine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-3-methoxypyridine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-3-methoxypyridine is COc1cccnc1-c1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-3-methoxypyridine?
The InChIKey is NZBUVWSVHUUQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO/c1-16-10-6-3-7-15-12(10)8-4-2-5-9(13)11(8)14/h2-7H,1H3.
What are the key properties of 2-(2,3-dichlorophenyl)-3-methoxypyridine?
2-(2,3-dichlorophenyl)-3-methoxypyridine has a molecular weight of 254.12 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-3-methoxypyridine is sourced from PubChem (CID 90122655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).