(2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone

C16H14F2O — CID 43159824

IUPAC(2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone
SMILESCC(C)c1ccc(C(=O)c2cc(F)ccc2F)cc1
InChIInChI=1S/C16H14F2O/c1-10(2)11-3-5-12(6-4-11)16(19)14-9-13(17)7-8-15(14)18/h3-10H,1-2H3
InChIKeyBYRCPLMJBUXEAD-UHFFFAOYSA-N
MW260.28 g/mol
LogP4.32
Rot. Bonds3

About (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone

(2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone (PubChem CID 43159824) has the molecular formula C16H14F2O and a molecular weight of 260.28 g/mol. Its IUPAC name is (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone.

Molecular Properties

Compound Name(2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone
PubChem CID43159824
Molecular FormulaC16H14F2O
Molecular Weight260.28 g/mol
Exact Mass260.10
IUPAC Name(2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone
SMILESCC(C)c1ccc(C(=O)c2cc(F)ccc2F)cc1
InChIInChI=1S/C16H14F2O/c1-10(2)11-3-5-12(6-4-11)16(19)14-9-13(17)7-8-15(14)18/h3-10H,1-2H3
InChIKeyBYRCPLMJBUXEAD-UHFFFAOYSA-N
XLogP4.32
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.28
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2,5-difluorophenyl)-(4-propan-2-yloxyphenyl)methanone
CID 63661997
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanone
CID 62802416
(2,5-difluorophenyl)-(4-methylsulfonylphenyl)methanone
CID 43337472
(2,4-dichlorophenyl)-(4-propan-2-ylphenyl)methanone
CID 43625036
(2,5-difluorophenyl)-(3-fluorophenyl)methanone
CID 43159843
(4-chloro-3-methoxyphenyl)-(2,5-difluorophenyl)methanone
CID 79699081
(5-bromo-2-fluorophenyl)-(4-butan-2-ylphenyl)methanone
CID 43337782
(2,4-dimethylphenyl)-(4-propan-2-ylphenyl)methanone
CID 43337891
(4-chlorophenyl)-(4-fluoro-2-hydroxyphenyl)methanone
CID 10399889
(4-fluoro-3,5-dimethylphenyl)-(4-propan-2-ylphenyl)methanone
CID 65299129
(3-bromo-5-chlorophenyl)-(2,5-difluorophenyl)methanone
CID 107944439
(3-bromo-5-fluorophenyl)-(4-propan-2-ylphenyl)methanone
CID 43625107

Frequently Asked Questions

What is the IUPAC name of (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone?
The IUPAC name of (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone (CID 43159824) is (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone.
What is the SMILES notation for (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone?
The canonical SMILES for (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone is CC(C)c1ccc(C(=O)c2cc(F)ccc2F)cc1.
What is the InChIKey of (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone?
The InChIKey is BYRCPLMJBUXEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2O/c1-10(2)11-3-5-12(6-4-11)16(19)14-9-13(17)7-8-15(14)18/h3-10H,1-2H3.
What are the key properties of (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone?
(2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone has a molecular weight of 260.28 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-(4-propan-2-ylphenyl)methanone is sourced from PubChem (CID 43159824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).