cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone

C14H17FO — CID 65298882

IUPACcyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone
SMILESCc1cc(C(=O)C2CCCC2)cc(C)c1F
InChIInChI=1S/C14H17FO/c1-9-7-12(8-10(2)13(9)15)14(16)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3
InChIKeyIYJUYZVHMVBNTL-UHFFFAOYSA-N
MW220.29 g/mol
LogP3.82
Rot. Bonds2

About cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone

cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone (PubChem CID 65298882) has the molecular formula C14H17FO and a molecular weight of 220.29 g/mol. Its IUPAC name is cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone.

Molecular Properties

Compound Namecyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone
PubChem CID65298882
Molecular FormulaC14H17FO
Molecular Weight220.29 g/mol
Exact Mass220.13
IUPAC Namecyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone
SMILESCc1cc(C(=O)C2CCCC2)cc(C)c1F
InChIInChI=1S/C14H17FO/c1-9-7-12(8-10(2)13(9)15)14(16)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3
InChIKeyIYJUYZVHMVBNTL-UHFFFAOYSA-N
XLogP3.82
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-bromo-3,5-dimethylphenyl)-cyclohexylmethanone
CID 114329532
cycloheptyl-(4-fluoro-3-methylphenyl)methanone
CID 65399772
(4-bromo-3,5-dimethylphenyl)-cyclobutylmethanone
CID 114329540
cyclohexyl-(3,5-difluorophenyl)methanone
CID 24724213
(4-fluoro-3,5-dimethylphenyl)-(2-methylcyclopentyl)methanone
CID 107176582
cyclobutyl-(3,5-dimethylphenyl)methanone
CID 24724134
cyclopropyl-(3,4,5-trifluorophenyl)methanone
CID 24724112
(3-amino-5-methylphenyl)-cyclopentylmethanone
CID 130689709
cyclopentyl-(3,5-dibromophenyl)methanone
CID 107976355
(4-bromo-3-methylphenyl)-cyclobutylmethanone
CID 115811405
(3-bromo-4-methylphenyl)-cyclopentylmethanone
CID 82122935
2-(4-fluoro-3,5-dimethylbenzoyl)-4-methylcyclopentane-1-carboxylic acid
CID 114392026

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone?
The IUPAC name of cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone (CID 65298882) is cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone.
What is the SMILES notation for cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone?
The canonical SMILES for cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone is Cc1cc(C(=O)C2CCCC2)cc(C)c1F.
What is the InChIKey of cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone?
The InChIKey is IYJUYZVHMVBNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FO/c1-9-7-12(8-10(2)13(9)15)14(16)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3.
What are the key properties of cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone?
cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone has a molecular weight of 220.29 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(4-fluoro-3,5-dimethylphenyl)methanone is sourced from PubChem (CID 65298882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).