2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole

C20H16FNO — CID 58362707

IUPAC2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole
SMILESFCCOc1ccc2cc(C3=Nc4ccccc4C3)ccc2c1
InChIInChI=1S/C20H16FNO/c21-9-10-23-18-8-7-14-11-17(6-5-15(14)12-18)20-13-16-3-1-2-4-19(16)22-20/h1-8,11-12H,9-10,13H2
InChIKeyQMNLWCHVZNQKNI-UHFFFAOYSA-N
MW305.35 g/mol
LogP4.86
Rot. Bonds4

About 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole

2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole (PubChem CID 58362707) has the molecular formula C20H16FNO and a molecular weight of 305.35 g/mol. Its IUPAC name is 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole.

Molecular Properties

Compound Name2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole
PubChem CID58362707
Molecular FormulaC20H16FNO
Molecular Weight305.35 g/mol
Exact Mass305.12
IUPAC Name2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole
SMILESFCCOc1ccc2cc(C3=Nc4ccccc4C3)ccc2c1
InChIInChI=1S/C20H16FNO/c21-9-10-23-18-8-7-14-11-17(6-5-15(14)12-18)20-13-16-3-1-2-4-19(16)22-20/h1-8,11-12H,9-10,13H2
InChIKeyQMNLWCHVZNQKNI-UHFFFAOYSA-N
XLogP4.86
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.35
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole?
The IUPAC name of 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole (CID 58362707) is 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole.
What is the SMILES notation for 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole?
The canonical SMILES for 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole is FCCOc1ccc2cc(C3=Nc4ccccc4C3)ccc2c1.
What is the InChIKey of 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole?
The InChIKey is QMNLWCHVZNQKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO/c21-9-10-23-18-8-7-14-11-17(6-5-15(14)12-18)20-13-16-3-1-2-4-19(16)22-20/h1-8,11-12H,9-10,13H2.
What are the key properties of 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole?
2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole has a molecular weight of 305.35 g/mol, XLogP of 4.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2-fluoroethoxy)naphthalen-2-yl]-3H-indole is sourced from PubChem (CID 58362707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).