1-(3-cyclopropyloxyphenyl)-1-phenylethanol

C17H18O2 — CID 114520749

IUPAC1-(3-cyclopropyloxyphenyl)-1-phenylethanol
SMILESCC(O)(c1ccccc1)c1cccc(OC2CC2)c1
InChIInChI=1S/C17H18O2/c1-17(18,13-6-3-2-4-7-13)14-8-5-9-16(12-14)19-15-10-11-15/h2-9,12,15,18H,10-11H2,1H3
InChIKeyTWBUHJDOIPPVNW-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.48
Rot. Bonds4

About 1-(3-cyclopropyloxyphenyl)-1-phenylethanol

1-(3-cyclopropyloxyphenyl)-1-phenylethanol (PubChem CID 114520749) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(3-cyclopropyloxyphenyl)-1-phenylethanol.

Molecular Properties

Compound Name1-(3-cyclopropyloxyphenyl)-1-phenylethanol
PubChem CID114520749
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-(3-cyclopropyloxyphenyl)-1-phenylethanol
SMILESCC(O)(c1ccccc1)c1cccc(OC2CC2)c1
InChIInChI=1S/C17H18O2/c1-17(18,13-6-3-2-4-7-13)14-8-5-9-16(12-14)19-15-10-11-15/h2-9,12,15,18H,10-11H2,1H3
InChIKeyTWBUHJDOIPPVNW-UHFFFAOYSA-N
XLogP3.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[1-(3-cyclopropyloxyphenyl)-1-hydroxyethyl]phenol
CID 114521016
1-(3-cyclopropyloxyphenyl)-1-(2-methylphenyl)ethanol
CID 114520751
1-(3-cyclopropyloxyphenyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanol
CID 140866719
(1S)-1-(3-methoxyphenyl)-1-phenylethanol
CID 29415940
1-(3-methoxyphenyl)-1-phenylethanol
CID 15680503
1-(3-ethoxyphenyl)-1-phenylethanol
CID 58452058
1-(tert-butylamino)-2-(3-cyclopropyloxyphenyl)propan-2-ol
CID 114523447
4-amino-2-(3-cyclopropyloxyphenyl)butan-2-ol
CID 114523428
3-(3-cyclopropyloxyphenyl)-2-methylpentan-3-ol
CID 114520776
1-(4-cyclopropyloxyphenyl)-1-(3,5-dimethylphenyl)ethanol
CID 114518706
4-[1-(4-cyclopropyloxyphenyl)-1-hydroxyethyl]phenol
CID 114518723
1-(3-cyclobutylphenyl)-1-(3-methoxyphenyl)ethanol
CID 114601094

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyloxyphenyl)-1-phenylethanol?
The IUPAC name of 1-(3-cyclopropyloxyphenyl)-1-phenylethanol (CID 114520749) is 1-(3-cyclopropyloxyphenyl)-1-phenylethanol.
What is the SMILES notation for 1-(3-cyclopropyloxyphenyl)-1-phenylethanol?
The canonical SMILES for 1-(3-cyclopropyloxyphenyl)-1-phenylethanol is CC(O)(c1ccccc1)c1cccc(OC2CC2)c1.
What is the InChIKey of 1-(3-cyclopropyloxyphenyl)-1-phenylethanol?
The InChIKey is TWBUHJDOIPPVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-17(18,13-6-3-2-4-7-13)14-8-5-9-16(12-14)19-15-10-11-15/h2-9,12,15,18H,10-11H2,1H3.
What are the key properties of 1-(3-cyclopropyloxyphenyl)-1-phenylethanol?
1-(3-cyclopropyloxyphenyl)-1-phenylethanol has a molecular weight of 254.33 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyloxyphenyl)-1-phenylethanol is sourced from PubChem (CID 114520749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).