cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol

C15H20O — CID 63902412

IUPACcyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol
SMILESCc1ccc(C)c(C(O)C2CC=CCC2)c1
InChIInChI=1S/C15H20O/c1-11-8-9-12(2)14(10-11)15(16)13-6-4-3-5-7-13/h3-4,8-10,13,15-16H,5-7H2,1-2H3
InChIKeyZGRNPUVAVNAELB-UHFFFAOYSA-N
MW216.32 g/mol
LogP3.69
Rot. Bonds2

About cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol

cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol (PubChem CID 63902412) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol.

Molecular Properties

Compound Namecyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol
PubChem CID63902412
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Namecyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol
SMILESCc1ccc(C)c(C(O)C2CC=CCC2)c1
InChIInChI=1S/C15H20O/c1-11-8-9-12(2)14(10-11)15(16)13-6-4-3-5-7-13/h3-4,8-10,13,15-16H,5-7H2,1-2H3
InChIKeyZGRNPUVAVNAELB-UHFFFAOYSA-N
XLogP3.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

cyclohex-3-en-1-yl-(3,4-dimethylphenyl)methanol
CID 63900775
cyclohex-3-en-1-yl-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723714
cyclohex-3-en-1-yl-(5-methylthiophen-3-yl)methanol
CID 65100027
cyclohex-3-en-1-yl(naphthalen-1-yl)methanol
CID 63900357
(2-bromo-5-methylphenyl)-cyclopropylmethanol
CID 115810293
(1R,2R)-1,2-di(cyclohex-3-en-1-yl)ethane-1,2-diol
CID 102217580
cyclohex-3-en-1-yl-(3,4-diethoxyphenyl)methanol
CID 63900983
cycloheptyl-(2,4-dimethylphenyl)methanol
CID 55199424
(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol
CID 80560260
2-cyclopropyl-2-(2,5-dimethylphenyl)acetic acid
CID 82024066
(5-bromo-2-methylphenyl)-pyrrolidin-3-ylmethanol
CID 83693932
(2-chloro-4-methylphenyl)-cyclopropylmethanol
CID 58392529

Frequently Asked Questions

What is the IUPAC name of cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol?
The IUPAC name of cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol (CID 63902412) is cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol.
What is the SMILES notation for cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol?
The canonical SMILES for cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol is Cc1ccc(C)c(C(O)C2CC=CCC2)c1.
What is the InChIKey of cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol?
The InChIKey is ZGRNPUVAVNAELB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-11-8-9-12(2)14(10-11)15(16)13-6-4-3-5-7-13/h3-4,8-10,13,15-16H,5-7H2,1-2H3.
What are the key properties of cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol?
cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol has a molecular weight of 216.32 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohex-3-en-1-yl-(2,5-dimethylphenyl)methanol is sourced from PubChem (CID 63902412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).