1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol

C15H22O3 — CID 105131484

IUPAC1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
SMILESCC(C)(C)OCC(O)c1cccc(OC2CC2)c1
InChIInChI=1S/C15H22O3/c1-15(2,3)17-10-14(16)11-5-4-6-13(9-11)18-12-7-8-12/h4-6,9,12,14,16H,7-8,10H2,1-3H3
InChIKeyFGXNSLWOWPZERC-UHFFFAOYSA-N
MW250.34 g/mol
LogP3.08
Rot. Bonds5

About 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol

1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol (PubChem CID 105131484) has the molecular formula C15H22O3 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol.

Molecular Properties

Compound Name1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
PubChem CID105131484
Molecular FormulaC15H22O3
Molecular Weight250.34 g/mol
Exact Mass250.16
IUPAC Name1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
SMILESCC(C)(C)OCC(O)c1cccc(OC2CC2)c1
InChIInChI=1S/C15H22O3/c1-15(2,3)17-10-14(16)11-5-4-6-13(9-11)18-12-7-8-12/h4-6,9,12,14,16H,7-8,10H2,1-3H3
InChIKeyFGXNSLWOWPZERC-UHFFFAOYSA-N
XLogP3.08
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-cyclopropyloxyphenyl)-2-propoxyethanol
CID 114521314
1-(3-cyclopropyloxyphenyl)-3,4,4-trimethylpentan-1-ol
CID 115838526
1-(3-cyclopropyloxyphenyl)-3,5,5-trimethylhexan-1-ol
CID 115838493
1-(3-cyclopropyloxyphenyl)-2-(4-methylphenyl)ethanol
CID 114521316
1-(3-cyclopropyloxyphenyl)-4-ethoxybutan-1-ol
CID 105131562
1-(3-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105078293
1-(3-cyclopropyloxyphenyl)-2-(3-ethoxycyclobutyl)ethanol
CID 103170310
1-(3-cyclopropyloxyphenyl)-3-propoxypropan-1-ol
CID 105131518
2-amino-1-(3-cyclohexyloxyphenyl)ethanol
CID 83824323
(3-cyclopropyloxyphenyl)-(2-methylcyclopentyl)methanol
CID 107193013
tert-butyl 2-(3-cyclopropyloxyphenyl)propanoate
CID 114522678
1-(3-cyclopropyloxyphenyl)-2-(2,5-dimethylphenyl)ethanol
CID 115838522

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
The IUPAC name of 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol (CID 105131484) is 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol.
What is the SMILES notation for 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
The canonical SMILES for 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol is CC(C)(C)OCC(O)c1cccc(OC2CC2)c1.
What is the InChIKey of 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
The InChIKey is FGXNSLWOWPZERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O3/c1-15(2,3)17-10-14(16)11-5-4-6-13(9-11)18-12-7-8-12/h4-6,9,12,14,16H,7-8,10H2,1-3H3.
What are the key properties of 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol has a molecular weight of 250.34 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol is sourced from PubChem (CID 105131484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).