1-fluoro-3-phenylindol-2-ol

C14H10FNO — CID 90706562

IUPAC1-fluoro-3-phenylindol-2-ol
SMILESOc1c(-c2ccccc2)c2ccccc2n1F
InChIInChI=1S/C14H10FNO/c15-16-12-9-5-4-8-11(12)13(14(16)17)10-6-2-1-3-7-10/h1-9,17H
InChIKeyHWHWXUJXQSIYNZ-UHFFFAOYSA-N
MW227.24 g/mol
LogP3.75
Rot. Bonds1

About 1-fluoro-3-phenylindol-2-ol

1-fluoro-3-phenylindol-2-ol (PubChem CID 90706562) has the molecular formula C14H10FNO and a molecular weight of 227.24 g/mol. Its IUPAC name is 1-fluoro-3-phenylindol-2-ol.

Molecular Properties

Compound Name1-fluoro-3-phenylindol-2-ol
PubChem CID90706562
Molecular FormulaC14H10FNO
Molecular Weight227.24 g/mol
Exact Mass227.07
IUPAC Name1-fluoro-3-phenylindol-2-ol
SMILESOc1c(-c2ccccc2)c2ccccc2n1F
InChIInChI=1S/C14H10FNO/c15-16-12-9-5-4-8-11(12)13(14(16)17)10-6-2-1-3-7-10/h1-9,17H
InChIKeyHWHWXUJXQSIYNZ-UHFFFAOYSA-N
XLogP3.75
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-phenylindol-2-ol?
The IUPAC name of 1-fluoro-3-phenylindol-2-ol (CID 90706562) is 1-fluoro-3-phenylindol-2-ol.
What is the SMILES notation for 1-fluoro-3-phenylindol-2-ol?
The canonical SMILES for 1-fluoro-3-phenylindol-2-ol is Oc1c(-c2ccccc2)c2ccccc2n1F.
What is the InChIKey of 1-fluoro-3-phenylindol-2-ol?
The InChIKey is HWHWXUJXQSIYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FNO/c15-16-12-9-5-4-8-11(12)13(14(16)17)10-6-2-1-3-7-10/h1-9,17H.
What are the key properties of 1-fluoro-3-phenylindol-2-ol?
1-fluoro-3-phenylindol-2-ol has a molecular weight of 227.24 g/mol, XLogP of 3.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-phenylindol-2-ol is sourced from PubChem (CID 90706562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).