2-(3,5-dichloro-4-methoxyphenyl)pyridine

C12H9Cl2NO — CID 135075623

IUPAC2-(3,5-dichloro-4-methoxyphenyl)pyridine
SMILESCOc1c(Cl)cc(-c2ccccn2)cc1Cl
InChIInChI=1S/C12H9Cl2NO/c1-16-12-9(13)6-8(7-10(12)14)11-4-2-3-5-15-11/h2-7H,1H3
InChIKeyPAEMUTZYNLBWOG-UHFFFAOYSA-N
MW254.12 g/mol
LogP4.06
Rot. Bonds2

About 2-(3,5-dichloro-4-methoxyphenyl)pyridine

2-(3,5-dichloro-4-methoxyphenyl)pyridine (PubChem CID 135075623) has the molecular formula C12H9Cl2NO and a molecular weight of 254.12 g/mol. Its IUPAC name is 2-(3,5-dichloro-4-methoxyphenyl)pyridine.

Molecular Properties

Compound Name2-(3,5-dichloro-4-methoxyphenyl)pyridine
PubChem CID135075623
Molecular FormulaC12H9Cl2NO
Molecular Weight254.12 g/mol
Exact Mass253.01
IUPAC Name2-(3,5-dichloro-4-methoxyphenyl)pyridine
SMILESCOc1c(Cl)cc(-c2ccccn2)cc1Cl
InChIInChI=1S/C12H9Cl2NO/c1-16-12-9(13)6-8(7-10(12)14)11-4-2-3-5-15-11/h2-7H,1H3
InChIKeyPAEMUTZYNLBWOG-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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Related Compounds

4-Chloro-7-methoxyquinoline
CID 10607829
Pyridine, 2-(4-ethoxyphenyl)-5-pentyl-
CID 3126242
2-(4-Methoxyphenyl)-5-pentylpyridine
CID 2058335
2-(4-Butoxyphenyl)pyridine
CID 11322128
2-(4-Methoxyphenyl)pyridine
CID 220239
3-[[2,6-Dichloro-4-[4-(1-methylpiperidin-4-yl)butyl]phenoxy]methyl]-2-methylpyridine
CID 137634794
2-[4-(Difluoromethoxy)phenyl]-5-propylpyridine
CID 2861850
2-(3,5-dichloro-2-methoxyphenyl)-1H-pyrrole
CID 14431148
2-(4-Methoxyphenyl)-5-(trifluoromethyl)pyridine
CID 11253795
5-Propyl-2-[4-(trifluoromethoxy)phenyl]pyridine
CID 836141
2-[4-(Difluoromethoxy)phenyl]-5-pentylpyridine
CID 2056967
2-[4-(Difluoromethoxy)phenyl]-5-heptylpyridine
CID 4023291

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichloro-4-methoxyphenyl)pyridine?
The IUPAC name of 2-(3,5-dichloro-4-methoxyphenyl)pyridine (CID 135075623) is 2-(3,5-dichloro-4-methoxyphenyl)pyridine.
What is the SMILES notation for 2-(3,5-dichloro-4-methoxyphenyl)pyridine?
The canonical SMILES for 2-(3,5-dichloro-4-methoxyphenyl)pyridine is COc1c(Cl)cc(-c2ccccn2)cc1Cl.
What is the InChIKey of 2-(3,5-dichloro-4-methoxyphenyl)pyridine?
The InChIKey is PAEMUTZYNLBWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO/c1-16-12-9(13)6-8(7-10(12)14)11-4-2-3-5-15-11/h2-7H,1H3.
What are the key properties of 2-(3,5-dichloro-4-methoxyphenyl)pyridine?
2-(3,5-dichloro-4-methoxyphenyl)pyridine 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-(3,5-dichloro-4-methoxyphenyl)pyridine is sourced from PubChem (CID 135075623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).