2-(3-fluorophenyl)-6-methoxynaphthalene

C17H13FO — CID 45156519

IUPAC2-(3-fluorophenyl)-6-methoxynaphthalene
SMILESCOc1ccc2cc(-c3cccc(F)c3)ccc2c1
InChIInChI=1S/C17H13FO/c1-19-17-8-7-14-9-13(5-6-15(14)11-17)12-3-2-4-16(18)10-12/h2-11H,1H3
InChIKeyWTWQMZWQDDVPND-UHFFFAOYSA-N
MW252.29 g/mol
LogP4.65
Rot. Bonds2

About 2-(3-fluorophenyl)-6-methoxynaphthalene

2-(3-fluorophenyl)-6-methoxynaphthalene (PubChem CID 45156519) has the molecular formula C17H13FO and a molecular weight of 252.29 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-6-methoxynaphthalene.

Molecular Properties

Compound Name2-(3-fluorophenyl)-6-methoxynaphthalene
PubChem CID45156519
Molecular FormulaC17H13FO
Molecular Weight252.29 g/mol
Exact Mass252.10
IUPAC Name2-(3-fluorophenyl)-6-methoxynaphthalene
SMILESCOc1ccc2cc(-c3cccc(F)c3)ccc2c1
InChIInChI=1S/C17H13FO/c1-19-17-8-7-14-9-13(5-6-15(14)11-17)12-3-2-4-16(18)10-12/h2-11H,1H3
InChIKeyWTWQMZWQDDVPND-UHFFFAOYSA-N
XLogP4.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-6-methoxynaphthalene?
The IUPAC name of 2-(3-fluorophenyl)-6-methoxynaphthalene (CID 45156519) is 2-(3-fluorophenyl)-6-methoxynaphthalene.
What is the SMILES notation for 2-(3-fluorophenyl)-6-methoxynaphthalene?
The canonical SMILES for 2-(3-fluorophenyl)-6-methoxynaphthalene is COc1ccc2cc(-c3cccc(F)c3)ccc2c1.
What is the InChIKey of 2-(3-fluorophenyl)-6-methoxynaphthalene?
The InChIKey is WTWQMZWQDDVPND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FO/c1-19-17-8-7-14-9-13(5-6-15(14)11-17)12-3-2-4-16(18)10-12/h2-11H,1H3.
What are the key properties of 2-(3-fluorophenyl)-6-methoxynaphthalene?
2-(3-fluorophenyl)-6-methoxynaphthalene has a molecular weight of 252.29 g/mol, XLogP of 4.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-6-methoxynaphthalene is sourced from PubChem (CID 45156519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).