2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine

C18H14F2N2 — CID 71045655

IUPAC2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine
SMILESCc1ccc(-c2cc(-c3ccc(C)cn3)c(F)cc2F)nc1
InChIInChI=1S/C18H14F2N2/c1-11-3-5-17(21-9-11)13-7-14(16(20)8-15(13)19)18-6-4-12(2)10-22-18/h3-10H,1-2H3
InChIKeyOJBVIBCLYCUDGE-UHFFFAOYSA-N
MW296.32 g/mol
LogP4.71
Rot. Bonds2

About 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine

2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine (PubChem CID 71045655) has the molecular formula C18H14F2N2 and a molecular weight of 296.32 g/mol. Its IUPAC name is 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine.

Molecular Properties

Compound Name2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine
PubChem CID71045655
Molecular FormulaC18H14F2N2
Molecular Weight296.32 g/mol
Exact Mass296.11
IUPAC Name2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine
SMILESCc1ccc(-c2cc(-c3ccc(C)cn3)c(F)cc2F)nc1
InChIInChI=1S/C18H14F2N2/c1-11-3-5-17(21-9-11)13-7-14(16(20)8-15(13)19)18-6-4-12(2)10-22-18/h3-10H,1-2H3
InChIKeyOJBVIBCLYCUDGE-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-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine?
The IUPAC name of 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine (CID 71045655) is 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine.
What is the SMILES notation for 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine?
The canonical SMILES for 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine is Cc1ccc(-c2cc(-c3ccc(C)cn3)c(F)cc2F)nc1.
What is the InChIKey of 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine?
The InChIKey is OJBVIBCLYCUDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2/c1-11-3-5-17(21-9-11)13-7-14(16(20)8-15(13)19)18-6-4-12(2)10-22-18/h3-10H,1-2H3.
What are the key properties of 2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine?
2-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine 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-[2,4-difluoro-5-(5-methyl-2-pyridinyl)phenyl]-5-methylpyridine is sourced from PubChem (CID 71045655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).