(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone

C14H11F2NO — CID 113229974

IUPAC(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)c2ccc(F)cc2F)c(C)n1
InChIInChI=1S/C14H11F2NO/c1-8-3-5-11(9(2)17-8)14(18)12-6-4-10(15)7-13(12)16/h3-7H,1-2H3
InChIKeyJXRQZMRVBFJDRJ-UHFFFAOYSA-N
MW247.24 g/mol
LogP3.21
Rot. Bonds2

About (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone

(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone (PubChem CID 113229974) has the molecular formula C14H11F2NO and a molecular weight of 247.24 g/mol. Its IUPAC name is (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone
PubChem CID113229974
Molecular FormulaC14H11F2NO
Molecular Weight247.24 g/mol
Exact Mass247.08
IUPAC Name(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)c2ccc(F)cc2F)c(C)n1
InChIInChI=1S/C14H11F2NO/c1-8-3-5-11(9(2)17-8)14(18)12-6-4-10(15)7-13(12)16/h3-7H,1-2H3
InChIKeyJXRQZMRVBFJDRJ-UHFFFAOYSA-N
XLogP3.21
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.24
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-difluoro-5-methylphenyl)-(2,4-difluorophenyl)methanone
CID 79731832
N-(2-amino-4-fluorophenyl)-2,6-dimethylpyridine-3-carboxamide
CID 62830762
(2,4-difluorophenyl)-(2,5-dimethylthiophen-3-yl)methanone
CID 43161425
(2,4-difluorophenyl)-(4-methylthiophen-3-yl)methanone
CID 79802242
(2,4-difluorophenyl)-(2-methylfuran-3-yl)methanone
CID 43462661
N-(2-amino-4,6-difluorophenyl)-2,6-dimethylpyridine-3-carboxamide
CID 81313433
(2,6-dimethyl-3-pyridinyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 115604695
(2-bromo-4-fluorophenyl)-(2,4-difluorophenyl)methanone
CID 43160008
(4-chlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone
CID 115604683
(2-bromo-4-methylphenyl)-(2,4-difluorophenyl)methanone;ethane
CID 142346677
(2,4-difluorophenyl)-(2-hydroxyphenyl)methanone
CID 11310853
(4-chloro-2-fluorophenyl)-(4-fluoro-2-methylphenyl)methanone
CID 55181742

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone?
The IUPAC name of (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone (CID 113229974) is (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone.
What is the SMILES notation for (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone?
The canonical SMILES for (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone is Cc1ccc(C(=O)c2ccc(F)cc2F)c(C)n1.
What is the InChIKey of (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone?
The InChIKey is JXRQZMRVBFJDRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NO/c1-8-3-5-11(9(2)17-8)14(18)12-6-4-10(15)7-13(12)16/h3-7H,1-2H3.
What are the key properties of (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone?
(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone has a molecular weight of 247.24 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone is sourced from PubChem (CID 113229974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).