1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol

C17H26O2 — CID 114794965

IUPAC1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1cccc(C(C)(O)C2CCCCC2)c1
InChIInChI=1S/C17H26O2/c1-13(2)19-16-11-7-10-15(12-16)17(3,18)14-8-5-4-6-9-14/h7,10-14,18H,4-6,8-9H2,1-3H3
InChIKeyGFTUUVLNQIJSCU-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.26
Rot. Bonds4

About 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol

1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol (PubChem CID 114794965) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol.

Molecular Properties

Compound Name1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol
PubChem CID114794965
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1cccc(C(C)(O)C2CCCCC2)c1
InChIInChI=1S/C17H26O2/c1-13(2)19-16-11-7-10-15(12-16)17(3,18)14-8-5-4-6-9-14/h7,10-14,18H,4-6,8-9H2,1-3H3
InChIKeyGFTUUVLNQIJSCU-UHFFFAOYSA-N
XLogP4.26
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-1-(4-propan-2-yloxyphenyl)ethanol
CID 114794846
1-cyclopropyl-1-(4-propan-2-yloxyphenyl)ethanol
CID 62796946
1-(3-chlorophenyl)-1-cyclohexylethanol
CID 43810110
(2S)-2-(3-propan-2-yloxyphenyl)pentan-2-ol
CID 97048457
1-cyclopropyl-1-(3-ethoxyphenyl)ethanol
CID 58452037
cyclooctyl-(3-propan-2-yloxyphenyl)methanol
CID 80604146
(1S)-1-cyclopropyl-1-(3-methylphenyl)ethanol
CID 93311992
1-(3-tert-butylphenyl)-1-cyclopropylethanol
CID 91657928
(1R)-1-cyclopentyl-1-phenylethanol;sulfane
CID 158992083
1-cyclohexyl-1-(3,4-dimethoxyphenyl)ethanol
CID 114794874
1-cyclohexyl-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 114194209
2,2-difluoro-2-(3-propan-2-yloxyphenyl)acetaldehyde
CID 105467397

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol?
The IUPAC name of 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol (CID 114794965) is 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol.
What is the SMILES notation for 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol?
The canonical SMILES for 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol is CC(C)Oc1cccc(C(C)(O)C2CCCCC2)c1.
What is the InChIKey of 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol?
The InChIKey is GFTUUVLNQIJSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-13(2)19-16-11-7-10-15(12-16)17(3,18)14-8-5-4-6-9-14/h7,10-14,18H,4-6,8-9H2,1-3H3.
What are the key properties of 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol?
1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol has a molecular weight of 262.39 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-(3-propan-2-yloxyphenyl)ethanol is sourced from PubChem (CID 114794965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).