2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine

C18H14F2N2 — CID 22899584

IUPAC2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine
SMILESCc1ccc(-c2ccc(-c3ccc(C)c(F)c3F)nc2)cn1
InChIInChI=1S/C18H14F2N2/c1-11-3-7-15(18(20)17(11)19)16-8-6-14(10-22-16)13-5-4-12(2)21-9-13/h3-10H,1-2H3
InChIKeySUEUMTYQJOAYBM-UHFFFAOYSA-N
MW296.32 g/mol
LogP4.71
Rot. Bonds2

About 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine

2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine (PubChem CID 22899584) has the molecular formula C18H14F2N2 and a molecular weight of 296.32 g/mol. Its IUPAC name is 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine.

Molecular Properties

Compound Name2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine
PubChem CID22899584
Molecular FormulaC18H14F2N2
Molecular Weight296.32 g/mol
Exact Mass296.11
IUPAC Name2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine
SMILESCc1ccc(-c2ccc(-c3ccc(C)c(F)c3F)nc2)cn1
InChIInChI=1S/C18H14F2N2/c1-11-3-7-15(18(20)17(11)19)16-8-6-14(10-22-16)13-5-4-12(2)21-9-13/h3-10H,1-2H3
InChIKeySUEUMTYQJOAYBM-UHFFFAOYSA-N
XLogP4.71
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine?
The IUPAC name of 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine (CID 22899584) is 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine.
What is the SMILES notation for 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine?
The canonical SMILES for 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine is Cc1ccc(-c2ccc(-c3ccc(C)c(F)c3F)nc2)cn1.
What is the InChIKey of 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine?
The InChIKey is SUEUMTYQJOAYBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2/c1-11-3-7-15(18(20)17(11)19)16-8-6-14(10-22-16)13-5-4-12(2)21-9-13/h3-10H,1-2H3.
What are the key properties of 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine?
2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine has a molecular weight of 296.32 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoro-4-methylphenyl)-5-(6-methyl-3-pyridinyl)pyridine is sourced from PubChem (CID 22899584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).