2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol

C14H19FO2 — CID 104610295

IUPAC2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol
SMILESCOC1(C(O)Cc2ccc(F)cc2)CCCC1
InChIInChI=1S/C14H19FO2/c1-17-14(8-2-3-9-14)13(16)10-11-4-6-12(15)7-5-11/h4-7,13,16H,2-3,8-10H2,1H3
InChIKeySXBHQOZFXNDENM-UHFFFAOYSA-N
MW238.30 g/mol
LogP2.69
Rot. Bonds4

About 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol

2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol (PubChem CID 104610295) has the molecular formula C14H19FO2 and a molecular weight of 238.30 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol
PubChem CID104610295
Molecular FormulaC14H19FO2
Molecular Weight238.30 g/mol
Exact Mass238.14
IUPAC Name2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol
SMILESCOC1(C(O)Cc2ccc(F)cc2)CCCC1
InChIInChI=1S/C14H19FO2/c1-17-14(8-2-3-9-14)13(16)10-11-4-6-12(15)7-5-11/h4-7,13,16H,2-3,8-10H2,1H3
InChIKeySXBHQOZFXNDENM-UHFFFAOYSA-N
XLogP2.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol?
The IUPAC name of 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol (CID 104610295) is 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol?
The canonical SMILES for 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol is COC1(C(O)Cc2ccc(F)cc2)CCCC1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol?
The InChIKey is SXBHQOZFXNDENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FO2/c1-17-14(8-2-3-9-14)13(16)10-11-4-6-12(15)7-5-11/h4-7,13,16H,2-3,8-10H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol?
2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol has a molecular weight of 238.30 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol is sourced from PubChem (CID 104610295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).