2-(2-fluoro-3-methylphenyl)naphthalene

C17H13F — CID 167454716

IUPAC2-(2-fluoro-3-methylphenyl)naphthalene
SMILESCc1cccc(-c2ccc3ccccc3c2)c1F
InChIInChI=1S/C17H13F/c1-12-5-4-8-16(17(12)18)15-10-9-13-6-2-3-7-14(13)11-15/h2-11H,1H3
InChIKeyGPOKMAWZLHLJGI-UHFFFAOYSA-N
MW236.29 g/mol
LogP4.95
Rot. Bonds1

About 2-(2-fluoro-3-methylphenyl)naphthalene

2-(2-fluoro-3-methylphenyl)naphthalene (PubChem CID 167454716) has the molecular formula C17H13F and a molecular weight of 236.29 g/mol. Its IUPAC name is 2-(2-fluoro-3-methylphenyl)naphthalene.

Molecular Properties

Compound Name2-(2-fluoro-3-methylphenyl)naphthalene
PubChem CID167454716
Molecular FormulaC17H13F
Molecular Weight236.29 g/mol
Exact Mass236.10
IUPAC Name2-(2-fluoro-3-methylphenyl)naphthalene
SMILESCc1cccc(-c2ccc3ccccc3c2)c1F
InChIInChI=1S/C17H13F/c1-12-5-4-8-16(17(12)18)15-10-9-13-6-2-3-7-14(13)11-15/h2-11H,1H3
InChIKeyGPOKMAWZLHLJGI-UHFFFAOYSA-N
XLogP4.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3-methylphenyl)naphthalene?
The IUPAC name of 2-(2-fluoro-3-methylphenyl)naphthalene (CID 167454716) is 2-(2-fluoro-3-methylphenyl)naphthalene.
What is the SMILES notation for 2-(2-fluoro-3-methylphenyl)naphthalene?
The canonical SMILES for 2-(2-fluoro-3-methylphenyl)naphthalene is Cc1cccc(-c2ccc3ccccc3c2)c1F.
What is the InChIKey of 2-(2-fluoro-3-methylphenyl)naphthalene?
The InChIKey is GPOKMAWZLHLJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F/c1-12-5-4-8-16(17(12)18)15-10-9-13-6-2-3-7-14(13)11-15/h2-11H,1H3.
What are the key properties of 2-(2-fluoro-3-methylphenyl)naphthalene?
2-(2-fluoro-3-methylphenyl)naphthalene has a molecular weight of 236.29 g/mol, XLogP of 4.95, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3-methylphenyl)naphthalene is sourced from PubChem (CID 167454716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).