[4-(4-fluorophenoxy)-1H-indol-2-yl]methanol

C15H12FNO2 — CID 135358749

IUPAC[4-(4-fluorophenoxy)-1H-indol-2-yl]methanol
SMILESOCc1cc2c(Oc3ccc(F)cc3)cccc2[nH]1
InChIInChI=1S/C15H12FNO2/c16-10-4-6-12(7-5-10)19-15-3-1-2-14-13(15)8-11(9-18)17-14/h1-8,17-18H,9H2
InChIKeyPKKQQOHUAPIIPZ-UHFFFAOYSA-N
MW257.26 g/mol
LogP3.59
Rot. Bonds3

About [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol

[4-(4-fluorophenoxy)-1H-indol-2-yl]methanol (PubChem CID 135358749) has the molecular formula C15H12FNO2 and a molecular weight of 257.26 g/mol. Its IUPAC name is [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol.

Molecular Properties

Compound Name[4-(4-fluorophenoxy)-1H-indol-2-yl]methanol
PubChem CID135358749
Molecular FormulaC15H12FNO2
Molecular Weight257.26 g/mol
Exact Mass257.09
IUPAC Name[4-(4-fluorophenoxy)-1H-indol-2-yl]methanol
SMILESOCc1cc2c(Oc3ccc(F)cc3)cccc2[nH]1
InChIInChI=1S/C15H12FNO2/c16-10-4-6-12(7-5-10)19-15-3-1-2-14-13(15)8-11(9-18)17-14/h1-8,17-18H,9H2
InChIKeyPKKQQOHUAPIIPZ-UHFFFAOYSA-N
XLogP3.59
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol?
The IUPAC name of [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol (CID 135358749) is [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol.
What is the SMILES notation for [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol?
The canonical SMILES for [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol is OCc1cc2c(Oc3ccc(F)cc3)cccc2[nH]1.
What is the InChIKey of [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol?
The InChIKey is PKKQQOHUAPIIPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO2/c16-10-4-6-12(7-5-10)19-15-3-1-2-14-13(15)8-11(9-18)17-14/h1-8,17-18H,9H2.
What are the key properties of [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol?
[4-(4-fluorophenoxy)-1H-indol-2-yl]methanol has a molecular weight of 257.26 g/mol, XLogP of 3.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluorophenoxy)-1H-indol-2-yl]methanol is sourced from PubChem (CID 135358749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).