1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol

C15H22O — CID 79863052

IUPAC1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
SMILESCc1ccc(C)c(C2(O)CCCC2(C)C)c1
InChIInChI=1S/C15H22O/c1-11-6-7-12(2)13(10-11)15(16)9-5-8-14(15,3)4/h6-7,10,16H,5,8-9H2,1-4H3
InChIKeyAAHMRFVRORWTPZ-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.70
Rot. Bonds1

About 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol

1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol (PubChem CID 79863052) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
PubChem CID79863052
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
SMILESCc1ccc(C)c(C2(O)CCCC2(C)C)c1
InChIInChI=1S/C15H22O/c1-11-6-7-12(2)13(10-11)15(16)9-5-8-14(15,3)4/h6-7,10,16H,5,8-9H2,1-4H3
InChIKeyAAHMRFVRORWTPZ-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluoro-2-methylphenyl)-2,2-dimethylcyclopentan-1-ol
CID 79863261
1-(2,5-dimethylphenyl)cycloheptan-1-ol
CID 62548506
1-(2,5-dimethylphenyl)cyclobutane-1-carboxylic acid
CID 82609045
1-(2-chlorophenyl)-2,2-dimethylcyclopentan-1-ol
CID 79862434
1-(2,5-dimethoxyphenyl)-2,2-dimethylcyclopentan-1-ol
CID 79862324
1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
CID 106679681
2,2-dimethyl-1-naphthalen-1-ylcyclopentan-1-ol
CID 79863482
1-[1-(2,5-dimethylphenyl)cyclopentyl]-N-methylmethanamine
CID 82471973
3-(2,5-dimethylphenyl)-2-methylpyrrolidin-3-ol
CID 3051399
2-bromo-1-(2,5-dimethylphenyl)cyclopent-2-en-1-ol
CID 10858443
2-(3-bromo-1-methylcyclopentyl)-1,4-dimethylbenzene
CID 116540790
1-(2,5-dimethylphenyl)-2,2-dimethylcyclopropane-1-carbonitrile
CID 116842259

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol (CID 79863052) is 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol is Cc1ccc(C)c(C2(O)CCCC2(C)C)c1.
What is the InChIKey of 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
The InChIKey is AAHMRFVRORWTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-11-6-7-12(2)13(10-11)15(16)9-5-8-14(15,3)4/h6-7,10,16H,5,8-9H2,1-4H3.
What are the key properties of 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol has a molecular weight of 218.34 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 79863052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).