1-cyclopropyl-1-(4-ethylphenyl)ethanol

C13H18O — CID 23255821

IUPAC1-cyclopropyl-1-(4-ethylphenyl)ethanol
SMILESCCc1ccc(C(C)(O)C2CC2)cc1
InChIInChI=1S/C13H18O/c1-3-10-4-6-11(7-5-10)13(2,14)12-8-9-12/h4-7,12,14H,3,8-9H2,1-2H3
InChIKeyOBLSLWFVYHTAMD-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.87
Rot. Bonds3

About 1-cyclopropyl-1-(4-ethylphenyl)ethanol

1-cyclopropyl-1-(4-ethylphenyl)ethanol (PubChem CID 23255821) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-cyclopropyl-1-(4-ethylphenyl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-1-(4-ethylphenyl)ethanol
PubChem CID23255821
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name1-cyclopropyl-1-(4-ethylphenyl)ethanol
SMILESCCc1ccc(C(C)(O)C2CC2)cc1
InChIInChI=1S/C13H18O/c1-3-10-4-6-11(7-5-10)13(2,14)12-8-9-12/h4-7,12,14H,3,8-9H2,1-2H3
InChIKeyOBLSLWFVYHTAMD-UHFFFAOYSA-N
XLogP2.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-ethylphenyl)-1-(6-oxaspiro[4.5]decan-9-yl)ethanol
CID 79902301
(1S)-1-cyclopropyl-1-(4-propan-2-ylphenyl)ethanol
CID 94604529
(1R)-1-cyclopropyl-1-pyridin-4-ylethanol
CID 124746902
1-tert-butyl-4-ethylbenzene
CID 157359507
4-(1-cyclohexyl-1-hydroxyethyl)phenol
CID 83075432
1-cyclopropyl-1-(4-propan-2-yloxyphenyl)ethanol
CID 62796946
3-(4-ethylphenyl)pentan-3-ol
CID 62543234
1-(3-tert-butylphenyl)-1-cyclopropylethanol
CID 91657928
1-cyclopropyl-1-pyrimidin-5-ylethanol
CID 62492242
(1R)-1-cyclopentyl-1-phenylethanol;sulfane
CID 158992083
1-[3-(aminomethyl)phenyl]-1-cyclopropylethanol
CID 115018710
1-cyclopropyl-1-(3,4-difluorophenyl)ethanol
CID 62802186

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(4-ethylphenyl)ethanol?
The IUPAC name of 1-cyclopropyl-1-(4-ethylphenyl)ethanol (CID 23255821) is 1-cyclopropyl-1-(4-ethylphenyl)ethanol.
What is the SMILES notation for 1-cyclopropyl-1-(4-ethylphenyl)ethanol?
The canonical SMILES for 1-cyclopropyl-1-(4-ethylphenyl)ethanol is CCc1ccc(C(C)(O)C2CC2)cc1.
What is the InChIKey of 1-cyclopropyl-1-(4-ethylphenyl)ethanol?
The InChIKey is OBLSLWFVYHTAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-3-10-4-6-11(7-5-10)13(2,14)12-8-9-12/h4-7,12,14H,3,8-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-(4-ethylphenyl)ethanol?
1-cyclopropyl-1-(4-ethylphenyl)ethanol has a molecular weight of 190.29 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(4-ethylphenyl)ethanol is sourced from PubChem (CID 23255821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).