6-fluoro-8-phenylnaphthalen-2-amine

C16H12FN — CID 142703941

IUPAC6-fluoro-8-phenylnaphthalen-2-amine
SMILESNc1ccc2cc(F)cc(-c3ccccc3)c2c1
InChIInChI=1S/C16H12FN/c17-13-8-12-6-7-14(18)10-16(12)15(9-13)11-4-2-1-3-5-11/h1-10H,18H2
InChIKeyQHBMMQOCKRQVGL-UHFFFAOYSA-N
MW237.28 g/mol
LogP4.23
Rot. Bonds1

About 6-fluoro-8-phenylnaphthalen-2-amine

6-fluoro-8-phenylnaphthalen-2-amine (PubChem CID 142703941) has the molecular formula C16H12FN and a molecular weight of 237.28 g/mol. Its IUPAC name is 6-fluoro-8-phenylnaphthalen-2-amine.

Molecular Properties

Compound Name6-fluoro-8-phenylnaphthalen-2-amine
PubChem CID142703941
Molecular FormulaC16H12FN
Molecular Weight237.28 g/mol
Exact Mass237.10
IUPAC Name6-fluoro-8-phenylnaphthalen-2-amine
SMILESNc1ccc2cc(F)cc(-c3ccccc3)c2c1
InChIInChI=1S/C16H12FN/c17-13-8-12-6-7-14(18)10-16(12)15(9-13)11-4-2-1-3-5-11/h1-10H,18H2
InChIKeyQHBMMQOCKRQVGL-UHFFFAOYSA-N
XLogP4.23
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-8-phenylnaphthalen-2-amine?
The IUPAC name of 6-fluoro-8-phenylnaphthalen-2-amine (CID 142703941) is 6-fluoro-8-phenylnaphthalen-2-amine.
What is the SMILES notation for 6-fluoro-8-phenylnaphthalen-2-amine?
The canonical SMILES for 6-fluoro-8-phenylnaphthalen-2-amine is Nc1ccc2cc(F)cc(-c3ccccc3)c2c1.
What is the InChIKey of 6-fluoro-8-phenylnaphthalen-2-amine?
The InChIKey is QHBMMQOCKRQVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN/c17-13-8-12-6-7-14(18)10-16(12)15(9-13)11-4-2-1-3-5-11/h1-10H,18H2.
What are the key properties of 6-fluoro-8-phenylnaphthalen-2-amine?
6-fluoro-8-phenylnaphthalen-2-amine has a molecular weight of 237.28 g/mol, XLogP of 4.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-8-phenylnaphthalen-2-amine is sourced from PubChem (CID 142703941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).