6-[1-(3-fluorophenyl)ethoxy]-1H-indole

C16H14FNO — CID 175599029

IUPAC6-[1-(3-fluorophenyl)ethoxy]-1H-indole
SMILESCC(Oc1ccc2cc[nH]c2c1)c1cccc(F)c1
InChIInChI=1S/C16H14FNO/c1-11(13-3-2-4-14(17)9-13)19-15-6-5-12-7-8-18-16(12)10-15/h2-11,18H,1H3
InChIKeyUOMXVPQXFPZPBT-UHFFFAOYSA-N
MW255.29 g/mol
LogP4.45
Rot. Bonds3

About 6-[1-(3-fluorophenyl)ethoxy]-1H-indole

6-[1-(3-fluorophenyl)ethoxy]-1H-indole (PubChem CID 175599029) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is 6-[1-(3-fluorophenyl)ethoxy]-1H-indole.

Molecular Properties

Compound Name6-[1-(3-fluorophenyl)ethoxy]-1H-indole
PubChem CID175599029
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name6-[1-(3-fluorophenyl)ethoxy]-1H-indole
SMILESCC(Oc1ccc2cc[nH]c2c1)c1cccc(F)c1
InChIInChI=1S/C16H14FNO/c1-11(13-3-2-4-14(17)9-13)19-15-6-5-12-7-8-18-16(12)10-15/h2-11,18H,1H3
InChIKeyUOMXVPQXFPZPBT-UHFFFAOYSA-N
XLogP4.45
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(3-fluorophenyl)ethoxy]-1H-indole?
The IUPAC name of 6-[1-(3-fluorophenyl)ethoxy]-1H-indole (CID 175599029) is 6-[1-(3-fluorophenyl)ethoxy]-1H-indole.
What is the SMILES notation for 6-[1-(3-fluorophenyl)ethoxy]-1H-indole?
The canonical SMILES for 6-[1-(3-fluorophenyl)ethoxy]-1H-indole is CC(Oc1ccc2cc[nH]c2c1)c1cccc(F)c1.
What is the InChIKey of 6-[1-(3-fluorophenyl)ethoxy]-1H-indole?
The InChIKey is UOMXVPQXFPZPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-11(13-3-2-4-14(17)9-13)19-15-6-5-12-7-8-18-16(12)10-15/h2-11,18H,1H3.
What are the key properties of 6-[1-(3-fluorophenyl)ethoxy]-1H-indole?
6-[1-(3-fluorophenyl)ethoxy]-1H-indole has a molecular weight of 255.29 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(3-fluorophenyl)ethoxy]-1H-indole is sourced from PubChem (CID 175599029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).