3-fluoro-1-phenylindol-2-olate

C14H9FNO- — CID 134957884

IUPAC3-fluoro-1-phenylindol-2-olate
SMILES[O-]c1c(F)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C14H10FNO/c15-13-11-8-4-5-9-12(11)16(14(13)17)10-6-2-1-3-7-10/h1-9,17H/p-1
InChIKeyOKEAGEZAAKLSGL-UHFFFAOYSA-M
MW226.23 g/mol
LogP2.84
Rot. Bonds1

About 3-fluoro-1-phenylindol-2-olate

3-fluoro-1-phenylindol-2-olate (PubChem CID 134957884) has the molecular formula C14H9FNO- and a molecular weight of 226.23 g/mol. Its IUPAC name is 3-fluoro-1-phenylindol-2-olate.

Molecular Properties

Compound Name3-fluoro-1-phenylindol-2-olate
PubChem CID134957884
Molecular FormulaC14H9FNO-
Molecular Weight226.23 g/mol
Exact Mass226.07
IUPAC Name3-fluoro-1-phenylindol-2-olate
SMILES[O-]c1c(F)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C14H10FNO/c15-13-11-8-4-5-9-12(11)16(14(13)17)10-6-2-1-3-7-10/h1-9,17H/p-1
InChIKeyOKEAGEZAAKLSGL-UHFFFAOYSA-M
XLogP2.84
TPSA27.99 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1-phenylindol-2-olate?
The IUPAC name of 3-fluoro-1-phenylindol-2-olate (CID 134957884) is 3-fluoro-1-phenylindol-2-olate.
What is the SMILES notation for 3-fluoro-1-phenylindol-2-olate?
The canonical SMILES for 3-fluoro-1-phenylindol-2-olate is [O-]c1c(F)c2ccccc2n1-c1ccccc1.
What is the InChIKey of 3-fluoro-1-phenylindol-2-olate?
The InChIKey is OKEAGEZAAKLSGL-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H10FNO/c15-13-11-8-4-5-9-12(11)16(14(13)17)10-6-2-1-3-7-10/h1-9,17H/p-1.
What are the key properties of 3-fluoro-1-phenylindol-2-olate?
3-fluoro-1-phenylindol-2-olate has a molecular weight of 226.23 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1-phenylindol-2-olate is sourced from PubChem (CID 134957884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).