3-(3,5-dichlorophenyl)-2-methylpyridine

C12H9Cl2N — CID 90167646

IUPAC3-(3,5-dichlorophenyl)-2-methylpyridine
SMILESCc1ncccc1-c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H9Cl2N/c1-8-12(3-2-4-15-8)9-5-10(13)7-11(14)6-9/h2-7H,1H3
InChIKeyFJKKQOFFSFYNHQ-UHFFFAOYSA-N
MW238.12 g/mol
LogP4.36
Rot. Bonds1

About 3-(3,5-dichlorophenyl)-2-methylpyridine

3-(3,5-dichlorophenyl)-2-methylpyridine (PubChem CID 90167646) has the molecular formula C12H9Cl2N and a molecular weight of 238.12 g/mol. Its IUPAC name is 3-(3,5-dichlorophenyl)-2-methylpyridine.

Molecular Properties

Compound Name3-(3,5-dichlorophenyl)-2-methylpyridine
PubChem CID90167646
Molecular FormulaC12H9Cl2N
Molecular Weight238.12 g/mol
Exact Mass237.01
IUPAC Name3-(3,5-dichlorophenyl)-2-methylpyridine
SMILESCc1ncccc1-c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H9Cl2N/c1-8-12(3-2-4-15-8)9-5-10(13)7-11(14)6-9/h2-7H,1H3
InChIKeyFJKKQOFFSFYNHQ-UHFFFAOYSA-N
XLogP4.36
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.12
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dichlorophenyl)-2-methylpyridine?
The IUPAC name of 3-(3,5-dichlorophenyl)-2-methylpyridine (CID 90167646) is 3-(3,5-dichlorophenyl)-2-methylpyridine.
What is the SMILES notation for 3-(3,5-dichlorophenyl)-2-methylpyridine?
The canonical SMILES for 3-(3,5-dichlorophenyl)-2-methylpyridine is Cc1ncccc1-c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3-(3,5-dichlorophenyl)-2-methylpyridine?
The InChIKey is FJKKQOFFSFYNHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2N/c1-8-12(3-2-4-15-8)9-5-10(13)7-11(14)6-9/h2-7H,1H3.
What are the key properties of 3-(3,5-dichlorophenyl)-2-methylpyridine?
3-(3,5-dichlorophenyl)-2-methylpyridine has a molecular weight of 238.12 g/mol, XLogP of 4.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dichlorophenyl)-2-methylpyridine is sourced from PubChem (CID 90167646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).