3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol

C14H20O — CID 81416562

IUPAC3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol
SMILESCCc1ccc(C2CC(O)C2(C)C)cc1
InChIInChI=1S/C14H20O/c1-4-10-5-7-11(8-6-10)12-9-13(15)14(12,2)3/h5-8,12-13,15H,4,9H2,1-3H3
InChIKeyFDSJZYHUMCMYSS-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.12
Rot. Bonds2

About 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol

3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol (PubChem CID 81416562) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol
PubChem CID81416562
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol
SMILESCCc1ccc(C2CC(O)C2(C)C)cc1
InChIInChI=1S/C14H20O/c1-4-10-5-7-11(8-6-10)12-9-13(15)14(12,2)3/h5-8,12-13,15H,4,9H2,1-3H3
InChIKeyFDSJZYHUMCMYSS-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2-dimethyl-3-(4-methylphenyl)cyclobutan-1-ol
CID 81416088
4-(2-ethyl-3-hydroxy-2-methylcyclobutyl)benzonitrile
CID 81416676
2-ethyl-2-methyl-3-pyridin-4-ylcyclobutan-1-ol
CID 81415976
1-(2-chlorocyclopropyl)-4-ethylbenzene
CID 154973164
2-ethyl-2-methyl-3-(4-nitrophenyl)cyclobutan-1-ol
CID 81416095
1-[3-(chloromethyl)-2,2-dimethylcyclopropyl]-4-ethylbenzene
CID 130489186
1-(4-ethylphenyl)-3,3,5,5-tetramethylpiperidin-4-ol
CID 139470827
(1R)-1-[(1S,2S)-2-(4-ethylphenyl)cyclopropyl]ethanol
CID 28912216
2-(4-ethylphenyl)oxirane
CID 10374595
1-cyclopropyl-4-ethylbenzene;ethane;methane
CID 176955448
2,2-dimethyl-3-(4-propylanilino)cyclobutan-1-ol
CID 112633298
alumane;1,4-diethylbenzene
CID 174296012

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol (CID 81416562) is 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol is CCc1ccc(C2CC(O)C2(C)C)cc1.
What is the InChIKey of 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol?
The InChIKey is FDSJZYHUMCMYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-4-10-5-7-11(8-6-10)12-9-13(15)14(12,2)3/h5-8,12-13,15H,4,9H2,1-3H3.
What are the key properties of 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol?
3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenyl)-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 81416562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).