2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine

C18H14F2N2 — CID 158332776

IUPAC2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine
SMILESC=C1C=CC(c2ccccc2)=C(c2c(F)cncc2F)N1C
InChIInChI=1S/C18H14F2N2/c1-12-8-9-14(13-6-4-3-5-7-13)18(22(12)2)17-15(19)10-21-11-16(17)20/h3-11H,1H2,2H3
InChIKeyGCNOXEXXBNZVJM-UHFFFAOYSA-N
MW296.32 g/mol
LogP4.24
Rot. Bonds2

About 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine

2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine (PubChem CID 158332776) has the molecular formula C18H14F2N2 and a molecular weight of 296.32 g/mol. Its IUPAC name is 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine.

Molecular Properties

Compound Name2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine
PubChem CID158332776
Molecular FormulaC18H14F2N2
Molecular Weight296.32 g/mol
Exact Mass296.11
IUPAC Name2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine
SMILESC=C1C=CC(c2ccccc2)=C(c2c(F)cncc2F)N1C
InChIInChI=1S/C18H14F2N2/c1-12-8-9-14(13-6-4-3-5-7-13)18(22(12)2)17-15(19)10-21-11-16(17)20/h3-11H,1H2,2H3
InChIKeyGCNOXEXXBNZVJM-UHFFFAOYSA-N
XLogP4.24
TPSA16.13 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 ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-6-fluorophenyl)-1-methyl-6-methylidene-3-phenylpyridine;ethane
CID 162135829
2-[4-(2,2-difluoroethoxy)-2,6-difluorophenyl]-1-methyl-6-methylidene-3-phenylpyridine;ethane
CID 162109193
5-bromo-2-(3,5-difluoro-4-pyridinyl)-1-ethyl-6-methylidene-3-phenylpyridine
CID 159915225
2-(2,6-difluoro-4-methylphenyl)-1-ethyl-6-methylidene-3-phenylpyridine
CID 162039035
1-(2,2-difluoroethyl)-2-(2,6-difluorophenyl)-6-methylidene-3-phenylpyridine;ethane
CID 161091403
1,3-dimethyl-6-methylidene-2-phenylpyridine
CID 161180948
1-(2,2-difluoroethyl)-2-(3,5-difluoro-4-pyridinyl)-5-methyl-6-methylidene-3-phenylpyridine;ethane
CID 162187456
1-(2,2-difluoroethyl)-2-(3,5-difluoro-4-pyridinyl)-5-iodo-6-methylidene-3-phenylpyridine;ethane
CID 158492269
3-fluoro-5-iodo-4-phenylpyridine
CID 131220912
2-(4-chloro-2,6-difluorophenyl)-5-fluoro-1-methyl-6-methylidene-3-phenylpyridine
CID 158300340
2-(4-bromo-2,6-difluorophenyl)-5-fluoro-1-methyl-6-methylidene-3-phenylpyridine;ethane
CID 158990261
2-(4-bromo-2,6-difluorophenyl)-5-chloro-1-methyl-6-methylidene-3-phenylpyridine
CID 158173923

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine?
The IUPAC name of 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine (CID 158332776) is 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine.
What is the SMILES notation for 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine?
The canonical SMILES for 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine is C=C1C=CC(c2ccccc2)=C(c2c(F)cncc2F)N1C.
What is the InChIKey of 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine?
The InChIKey is GCNOXEXXBNZVJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2/c1-12-8-9-14(13-6-4-3-5-7-13)18(22(12)2)17-15(19)10-21-11-16(17)20/h3-11H,1H2,2H3.
What are the key properties of 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine?
2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine has a molecular weight of 296.32 g/mol, XLogP of 4.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluoro-4-pyridinyl)-1-methyl-6-methylidene-3-phenylpyridine is sourced from PubChem (CID 158332776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).