7-fluoro-N,N-dimethylnaphthalen-2-amine

C12H12FN — CID 166120526

IUPAC7-fluoro-N,N-dimethylnaphthalen-2-amine
SMILESCN(C)c1ccc2ccc(F)cc2c1
InChIInChI=1S/C12H12FN/c1-14(2)12-6-4-9-3-5-11(13)7-10(9)8-12/h3-8H,1-2H3
InChIKeyZYHKVMYXKGIMAI-UHFFFAOYSA-N
MW189.23 g/mol
LogP3.04
Rot. Bonds1

About 7-fluoro-N,N-dimethylnaphthalen-2-amine

7-fluoro-N,N-dimethylnaphthalen-2-amine (PubChem CID 166120526) has the molecular formula C12H12FN and a molecular weight of 189.23 g/mol. Its IUPAC name is 7-fluoro-N,N-dimethylnaphthalen-2-amine.

Molecular Properties

Compound Name7-fluoro-N,N-dimethylnaphthalen-2-amine
PubChem CID166120526
Molecular FormulaC12H12FN
Molecular Weight189.23 g/mol
Exact Mass189.10
IUPAC Name7-fluoro-N,N-dimethylnaphthalen-2-amine
SMILESCN(C)c1ccc2ccc(F)cc2c1
InChIInChI=1S/C12H12FN/c1-14(2)12-6-4-9-3-5-11(13)7-10(9)8-12/h3-8H,1-2H3
InChIKeyZYHKVMYXKGIMAI-UHFFFAOYSA-N
XLogP3.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.23
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N,N-dimethylnaphthalen-2-amine?
The IUPAC name of 7-fluoro-N,N-dimethylnaphthalen-2-amine (CID 166120526) is 7-fluoro-N,N-dimethylnaphthalen-2-amine.
What is the SMILES notation for 7-fluoro-N,N-dimethylnaphthalen-2-amine?
The canonical SMILES for 7-fluoro-N,N-dimethylnaphthalen-2-amine is CN(C)c1ccc2ccc(F)cc2c1.
What is the InChIKey of 7-fluoro-N,N-dimethylnaphthalen-2-amine?
The InChIKey is ZYHKVMYXKGIMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN/c1-14(2)12-6-4-9-3-5-11(13)7-10(9)8-12/h3-8H,1-2H3.
What are the key properties of 7-fluoro-N,N-dimethylnaphthalen-2-amine?
7-fluoro-N,N-dimethylnaphthalen-2-amine has a molecular weight of 189.23 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N,N-dimethylnaphthalen-2-amine is sourced from PubChem (CID 166120526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).