1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol

C17H24O2 — CID 114602475

IUPAC1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol
SMILESCCOC(C1CC1)C(O)c1ccccc1C1CCC1
InChIInChI=1S/C17H24O2/c1-2-19-17(13-10-11-13)16(18)15-9-4-3-8-14(15)12-6-5-7-12/h3-4,8-9,12-13,16-18H,2,5-7,10-11H2,1H3
InChIKeyXJNVUFFKVRDVLM-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.80
Rot. Bonds6

About 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol

1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol (PubChem CID 114602475) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol.

Molecular Properties

Compound Name1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol
PubChem CID114602475
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol
SMILESCCOC(C1CC1)C(O)c1ccccc1C1CCC1
InChIInChI=1S/C17H24O2/c1-2-19-17(13-10-11-13)16(18)15-9-4-3-8-14(15)12-6-5-7-12/h3-4,8-9,12-13,16-18H,2,5-7,10-11H2,1H3
InChIKeyXJNVUFFKVRDVLM-UHFFFAOYSA-N
XLogP3.80
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclobutylphenyl)-2,2-diethoxyethanol
CID 114602355
1-(2-cyclobutylphenyl)butane-1,2-diol
CID 103454593
1-(2-cyclobutylphenyl)-2-ethoxy-3,3-dimethylbutan-1-amine
CID 114604774
1-(2-cyclobutylphenyl)-2-phenylpropan-1-ol
CID 114601326
2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116712968
1-(2-cyclobutylphenyl)-2-ethoxy-N-methylpentan-1-amine
CID 114604701
1-cyclopropyl-1-ethoxy-3-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-ol
CID 116712738
2-cyclopropyl-2-ethoxy-1-(3-ethoxyphenyl)ethanol
CID 116712902
(1R)-1-[2-(2-cyclobutylphenyl)phenyl]ethanol
CID 71129039
1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol
CID 116712819
2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116756745
(2-cyclobutylphenyl)-cyclopropylmethanamine
CID 114602603

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol?
The IUPAC name of 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol (CID 114602475) is 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol.
What is the SMILES notation for 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol?
The canonical SMILES for 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol is CCOC(C1CC1)C(O)c1ccccc1C1CCC1.
What is the InChIKey of 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol?
The InChIKey is XJNVUFFKVRDVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O2/c1-2-19-17(13-10-11-13)16(18)15-9-4-3-8-14(15)12-6-5-7-12/h3-4,8-9,12-13,16-18H,2,5-7,10-11H2,1H3.
What are the key properties of 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol?
1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol has a molecular weight of 260.38 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol is sourced from PubChem (CID 114602475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).