1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol

C17H17FO — CID 116516707

IUPAC1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol
SMILESCC(O)(c1ccccc1F)C1CC1c1ccccc1
InChIInChI=1S/C17H17FO/c1-17(19,14-9-5-6-10-16(14)18)15-11-13(15)12-7-3-2-4-8-12/h2-10,13,15,19H,11H2,1H3
InChIKeySHZCXNDJXLSDOK-UHFFFAOYSA-N
MW256.32 g/mol
LogP3.84
Rot. Bonds3

About 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol

1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol (PubChem CID 116516707) has the molecular formula C17H17FO and a molecular weight of 256.32 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol
PubChem CID116516707
Molecular FormulaC17H17FO
Molecular Weight256.32 g/mol
Exact Mass256.13
IUPAC Name1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol
SMILESCC(O)(c1ccccc1F)C1CC1c1ccccc1
InChIInChI=1S/C17H17FO/c1-17(19,14-9-5-6-10-16(14)18)15-11-13(15)12-7-3-2-4-8-12/h2-10,13,15,19H,11H2,1H3
InChIKeySHZCXNDJXLSDOK-UHFFFAOYSA-N
XLogP3.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(1S,2S)-2-phenylcyclopropyl]propan-2-ol
CID 102315759
[(1S)-2-tert-butylcyclopropyl]benzene
CID 59541250
2-phenyl-2-(2-phenylcyclopropyl)butan-1-ol
CID 116518430
(2S)-2-(2-fluorophenyl)-2-hydroxypropanoic acid
CID 55255014
2-(2-fluorophenyl)-2-[(2-methylcyclopropyl)amino]propanoic acid
CID 115001941
1-(4-methoxyphenyl)-2-(2-phenylcyclopropyl)propan-2-ol
CID 116516743
1-(2-fluorophenyl)-1-[2-(trifluoromethyl)phenyl]ethanol
CID 62802798
2-(cyclobutylamino)-2-(2-fluorophenyl)propanoic acid
CID 115001938
1-cyclopropyl-1-(2-fluorophenyl)propan-1-ol
CID 64918927
diphenyl-[(1S,2S)-2-pyridin-4-ylcyclopropyl]methanol
CID 92533340
1,1-bis(2-fluorophenyl)propan-1-ol
CID 112679425
sodium;2-(2-fluorophenyl)-2-methylpropanoic acid;hydride
CID 173208060

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol?
The IUPAC name of 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol (CID 116516707) is 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol?
The canonical SMILES for 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol is CC(O)(c1ccccc1F)C1CC1c1ccccc1.
What is the InChIKey of 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol?
The InChIKey is SHZCXNDJXLSDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO/c1-17(19,14-9-5-6-10-16(14)18)15-11-13(15)12-7-3-2-4-8-12/h2-10,13,15,19H,11H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol?
1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol has a molecular weight of 256.32 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-1-(2-phenylcyclopropyl)ethanol is sourced from PubChem (CID 116516707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).