2-(2,5-dichlorophenyl)-4-methoxypyridine

C12H9Cl2NO — CID 118819379

IUPAC2-(2,5-dichlorophenyl)-4-methoxypyridine
SMILESCOc1ccnc(-c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C12H9Cl2NO/c1-16-9-4-5-15-12(7-9)10-6-8(13)2-3-11(10)14/h2-7H,1H3
InChIKeyGXNODEUVBXKTLE-UHFFFAOYSA-N
MW254.12 g/mol
LogP4.06
Rot. Bonds2

About 2-(2,5-dichlorophenyl)-4-methoxypyridine

2-(2,5-dichlorophenyl)-4-methoxypyridine (PubChem CID 118819379) has the molecular formula C12H9Cl2NO and a molecular weight of 254.12 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-4-methoxypyridine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-4-methoxypyridine
PubChem CID118819379
Molecular FormulaC12H9Cl2NO
Molecular Weight254.12 g/mol
Exact Mass253.01
IUPAC Name2-(2,5-dichlorophenyl)-4-methoxypyridine
SMILESCOc1ccnc(-c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C12H9Cl2NO/c1-16-9-4-5-15-12(7-9)10-6-8(13)2-3-11(10)14/h2-7H,1H3
InChIKeyGXNODEUVBXKTLE-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-(2,5-dichlorophenyl)-4-methoxypyridine?
The IUPAC name of 2-(2,5-dichlorophenyl)-4-methoxypyridine (CID 118819379) is 2-(2,5-dichlorophenyl)-4-methoxypyridine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-4-methoxypyridine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-4-methoxypyridine is COc1ccnc(-c2cc(Cl)ccc2Cl)c1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-4-methoxypyridine?
The InChIKey is GXNODEUVBXKTLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO/c1-16-9-4-5-15-12(7-9)10-6-8(13)2-3-11(10)14/h2-7H,1H3.
What are the key properties of 2-(2,5-dichlorophenyl)-4-methoxypyridine?
2-(2,5-dichlorophenyl)-4-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-(2,5-dichlorophenyl)-4-methoxypyridine is sourced from PubChem (CID 118819379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).