2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol

C19H22O — CID 63017736

IUPAC2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol
SMILESCc1ccc(C)c(CC(O)C2(c3ccccc3)CC2)c1
InChIInChI=1S/C19H22O/c1-14-8-9-15(2)16(12-14)13-18(20)19(10-11-19)17-6-4-3-5-7-17/h3-9,12,18,20H,10-11,13H2,1-2H3
InChIKeyYOCROUPEQWVMMF-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.94
Rot. Bonds4

About 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol

2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol (PubChem CID 63017736) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol
PubChem CID63017736
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol
SMILESCc1ccc(C)c(CC(O)C2(c3ccccc3)CC2)c1
InChIInChI=1S/C19H22O/c1-14-8-9-15(2)16(12-14)13-18(20)19(10-11-19)17-6-4-3-5-7-17/h3-9,12,18,20H,10-11,13H2,1-2H3
InChIKeyYOCROUPEQWVMMF-UHFFFAOYSA-N
XLogP3.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methoxy-5-methylphenyl)-1-(1-phenylcyclopropyl)ethanol
CID 63078954
1-(1-phenylcyclopropyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 63079128
2-(4-methylphenyl)-1-(1-phenylcyclobutyl)ethanol
CID 63080555
2-(4-methylphenyl)-1-(1-phenylcyclopentyl)ethanol
CID 63414353
(2R)-1-(2,5-dimethylphenyl)butan-2-ol
CID 94208295
2-(4-chloro-2-fluorophenyl)-1-(1-phenylcyclopropyl)ethanol
CID 114854613
2-phenyl-1-(1-phenylcyclopentyl)ethanol
CID 63080283
1-(1-adamantyl)-2-(2,5-dimethylphenyl)ethanol
CID 63410825
2-(2,5-dimethylphenyl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanol
CID 79060566
N-[(2,4-dimethylphenyl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 63417836
1-cyclopropyl-2-(2,5-dimethylphenyl)ethanol
CID 61481966
3-(2,5-dimethylphenyl)-2-phenylpropanenitrile
CID 82141321

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol?
The IUPAC name of 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol (CID 63017736) is 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol?
The canonical SMILES for 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol is Cc1ccc(C)c(CC(O)C2(c3ccccc3)CC2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol?
The InChIKey is YOCROUPEQWVMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-14-8-9-15(2)16(12-14)13-18(20)19(10-11-19)17-6-4-3-5-7-17/h3-9,12,18,20H,10-11,13H2,1-2H3.
What are the key properties of 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol?
2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol has a molecular weight of 266.38 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-1-(1-phenylcyclopropyl)ethanol is sourced from PubChem (CID 63017736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).