2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol

C18H28O2 — CID 116756745

IUPAC2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
SMILESCCOC(C1CCCCC1)C(O)c1cc(C)ccc1C
InChIInChI=1S/C18H28O2/c1-4-20-18(15-8-6-5-7-9-15)17(19)16-12-13(2)10-11-14(16)3/h10-12,15,17-19H,4-9H2,1-3H3
InChIKeyGJKZQCVHCCUBDM-UHFFFAOYSA-N
MW276.42 g/mol
LogP4.32
Rot. Bonds5

About 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol

2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol (PubChem CID 116756745) has the molecular formula C18H28O2 and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol.

Molecular Properties

Compound Name2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
PubChem CID116756745
Molecular FormulaC18H28O2
Molecular Weight276.42 g/mol
Exact Mass276.21
IUPAC Name2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
SMILESCCOC(C1CCCCC1)C(O)c1cc(C)ccc1C
InChIInChI=1S/C18H28O2/c1-4-20-18(15-8-6-5-7-9-15)17(19)16-12-13(2)10-11-14(16)3/h10-12,15,17-19H,4-9H2,1-3H3
InChIKeyGJKZQCVHCCUBDM-UHFFFAOYSA-N
XLogP4.32
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116712968
1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol
CID 116756726
1-(2,5-dimethylphenyl)-2-ethoxybutan-1-ol
CID 116711234
2-cyclopropyl-2-ethoxy-1-(4-methoxy-2,5-dimethylphenyl)ethanol
CID 116712960
2-cyclohexyl-1-(3,5-difluorophenyl)-2-ethoxyethanol
CID 116756591
2-cyclohexyl-2-ethoxy-1-(4-methyl-3-pyridinyl)ethanamine
CID 116772054
2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
CID 116756693
3-cyclohexyl-1-(2,5-dimethylphenyl)propan-1-ol
CID 55200190
[2-cyclohexyl-2-ethoxy-1-(2-methylphenyl)ethyl]hydrazine
CID 105278786
2-cyclohexyl-2-ethoxy-1-(3-fluoro-4-methylphenyl)ethanamine
CID 107129246
1-(2,5-dimethylphenyl)-2-ethylbutan-1-ol
CID 61088457
1-cyclohexyl-2-(2-methoxy-5-methylphenyl)ethane-1,2-diol
CID 103459031

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
The IUPAC name of 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol (CID 116756745) is 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol.
What is the SMILES notation for 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
The canonical SMILES for 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol is CCOC(C1CCCCC1)C(O)c1cc(C)ccc1C.
What is the InChIKey of 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
The InChIKey is GJKZQCVHCCUBDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O2/c1-4-20-18(15-8-6-5-7-9-15)17(19)16-12-13(2)10-11-14(16)3/h10-12,15,17-19H,4-9H2,1-3H3.
What are the key properties of 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol has a molecular weight of 276.42 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol is sourced from PubChem (CID 116756745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).