cyclopentyl-(2,6-dimethylphenyl)methanone

C14H18O — CID 24724167

IUPACcyclopentyl-(2,6-dimethylphenyl)methanone
SMILESCc1cccc(C)c1C(=O)C1CCCC1
InChIInChI=1S/C14H18O/c1-10-6-5-7-11(2)13(10)14(15)12-8-3-4-9-12/h5-7,12H,3-4,8-9H2,1-2H3
InChIKeyUXXVCUNAMBGRMQ-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.68
Rot. Bonds2

About cyclopentyl-(2,6-dimethylphenyl)methanone

cyclopentyl-(2,6-dimethylphenyl)methanone (PubChem CID 24724167) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is cyclopentyl-(2,6-dimethylphenyl)methanone.

Molecular Properties

Compound Namecyclopentyl-(2,6-dimethylphenyl)methanone
PubChem CID24724167
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Namecyclopentyl-(2,6-dimethylphenyl)methanone
SMILESCc1cccc(C)c1C(=O)C1CCCC1
InChIInChI=1S/C14H18O/c1-10-6-5-7-11(2)13(10)14(15)12-8-3-4-9-12/h5-7,12H,3-4,8-9H2,1-2H3
InChIKeyUXXVCUNAMBGRMQ-UHFFFAOYSA-N
XLogP3.68
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cyclobutyl-(2,6-dimethylphenyl)methanone
CID 24724132
cyclooctyl-(2-methylphenyl)methanone
CID 80602643
cycloheptyl-(2,6-dimethoxyphenyl)methanone
CID 116810005
cyclopentyl 2,6-dimethylbenzenecarboperoxoate
CID 173265603
cyclohexyl-[3,6-diamino-2-(cyclohexanecarbonyl)phenyl]methanone
CID 175039329
(3-chloro-2-methylphenyl)-cycloheptylmethanone
CID 107101795
2-cyclopentyl-6-methylbenzoyl chloride
CID 144574773
(2-bromo-6-fluorophenyl)-cyclopentylmethanone
CID 114885328
cyclopropyl-(2-fluoro-3-methylphenyl)methanone
CID 70266703
N-(2-carbamothioyl-3-methylphenyl)cyclohexanecarboxamide
CID 107805800
cyclooctyl-(2-methyl-1H-indol-3-yl)methanone
CID 65018781
(3-bromo-2-methylphenyl)-cyclohexylmethanone
CID 114962200

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(2,6-dimethylphenyl)methanone?
The IUPAC name of cyclopentyl-(2,6-dimethylphenyl)methanone (CID 24724167) is cyclopentyl-(2,6-dimethylphenyl)methanone.
What is the SMILES notation for cyclopentyl-(2,6-dimethylphenyl)methanone?
The canonical SMILES for cyclopentyl-(2,6-dimethylphenyl)methanone is Cc1cccc(C)c1C(=O)C1CCCC1.
What is the InChIKey of cyclopentyl-(2,6-dimethylphenyl)methanone?
The InChIKey is UXXVCUNAMBGRMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-10-6-5-7-11(2)13(10)14(15)12-8-3-4-9-12/h5-7,12H,3-4,8-9H2,1-2H3.
What are the key properties of cyclopentyl-(2,6-dimethylphenyl)methanone?
cyclopentyl-(2,6-dimethylphenyl)methanone has a molecular weight of 202.30 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(2,6-dimethylphenyl)methanone is sourced from PubChem (CID 24724167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).