2-(3-fluoropropyl)naphthalene

C13H13F — CID 11389859

IUPAC2-(3-fluoropropyl)naphthalene
SMILESFCCCc1ccc2ccccc2c1
InChIInChI=1S/C13H13F/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11/h1-2,5-8,10H,3-4,9H2
InChIKeyUXHNVNFRIUEEDM-UHFFFAOYSA-N
MW188.24 g/mol
LogP3.74
Rot. Bonds3

About 2-(3-fluoropropyl)naphthalene

2-(3-fluoropropyl)naphthalene (PubChem CID 11389859) has the molecular formula C13H13F and a molecular weight of 188.24 g/mol. Its IUPAC name is 2-(3-fluoropropyl)naphthalene.

Molecular Properties

Compound Name2-(3-fluoropropyl)naphthalene
PubChem CID11389859
Molecular FormulaC13H13F
Molecular Weight188.24 g/mol
Exact Mass188.10
IUPAC Name2-(3-fluoropropyl)naphthalene
SMILESFCCCc1ccc2ccccc2c1
InChIInChI=1S/C13H13F/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11/h1-2,5-8,10H,3-4,9H2
InChIKeyUXHNVNFRIUEEDM-UHFFFAOYSA-N
XLogP3.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.24
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoropropyl)naphthalene?
The IUPAC name of 2-(3-fluoropropyl)naphthalene (CID 11389859) is 2-(3-fluoropropyl)naphthalene.
What is the SMILES notation for 2-(3-fluoropropyl)naphthalene?
The canonical SMILES for 2-(3-fluoropropyl)naphthalene is FCCCc1ccc2ccccc2c1.
What is the InChIKey of 2-(3-fluoropropyl)naphthalene?
The InChIKey is UXHNVNFRIUEEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11/h1-2,5-8,10H,3-4,9H2.
What are the key properties of 2-(3-fluoropropyl)naphthalene?
2-(3-fluoropropyl)naphthalene has a molecular weight of 188.24 g/mol, XLogP of 3.74, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoropropyl)naphthalene is sourced from PubChem (CID 11389859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).