2-fluoro-N-methyl-1-phenylethanamine

C9H12FN — CID 83815397

IUPAC2-fluoro-N-methyl-1-phenylethanamine
SMILESCNC(CF)c1ccccc1
InChIInChI=1S/C9H12FN/c1-11-9(7-10)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3
InChIKeyJSAXNKBEQLQLKN-UHFFFAOYSA-N
MW153.20 g/mol
LogP1.92
Rot. Bonds3

About 2-fluoro-N-methyl-1-phenylethanamine

2-fluoro-N-methyl-1-phenylethanamine (PubChem CID 83815397) has the molecular formula C9H12FN and a molecular weight of 153.20 g/mol. Its IUPAC name is 2-fluoro-N-methyl-1-phenylethanamine.

Molecular Properties

Compound Name2-fluoro-N-methyl-1-phenylethanamine
PubChem CID83815397
Molecular FormulaC9H12FN
Molecular Weight153.20 g/mol
Exact Mass153.10
IUPAC Name2-fluoro-N-methyl-1-phenylethanamine
SMILESCNC(CF)c1ccccc1
InChIInChI=1S/C9H12FN/c1-11-9(7-10)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3
InChIKeyJSAXNKBEQLQLKN-UHFFFAOYSA-N
XLogP1.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.20
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-2-fluoro-N-methyl-1-(4-methylphenyl)ethanamine
CID 90212789
1-(4-chlorophenyl)-2-fluoro-N-methylethanamine
CID 83817763
(1S)-N-methyl-1-phenylpentan-1-amine
CID 86314170
N-methyl-1-phenyl-2-(thian-4-yl)ethanamine
CID 105083854
N-methyl-1,4-diphenylbut-3-en-1-amine
CID 54080999
2-(2-bromophenyl)-N-methyl-1-phenylethanamine
CID 60820242
2-(4-iodophenyl)-N-methyl-1-phenylethanamine
CID 65479327
N-methyl-1-phenyl-3-propan-2-yloxypropan-1-amine
CID 114998457
N-methyl-1-phenyl-2-propylsulfanylethanamine
CID 64613859
2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-methyl-1-phenylethanamine
CID 66419580
2-butan-2-ylsulfanyl-N-methyl-1-phenylethanamine
CID 64613225
N'-[2-(dimethylamino)ethyl]-N,N'-dimethyl-1-phenylethane-1,2-diamine
CID 14545863

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-1-phenylethanamine?
The IUPAC name of 2-fluoro-N-methyl-1-phenylethanamine (CID 83815397) is 2-fluoro-N-methyl-1-phenylethanamine.
What is the SMILES notation for 2-fluoro-N-methyl-1-phenylethanamine?
The canonical SMILES for 2-fluoro-N-methyl-1-phenylethanamine is CNC(CF)c1ccccc1.
What is the InChIKey of 2-fluoro-N-methyl-1-phenylethanamine?
The InChIKey is JSAXNKBEQLQLKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FN/c1-11-9(7-10)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3.
What are the key properties of 2-fluoro-N-methyl-1-phenylethanamine?
2-fluoro-N-methyl-1-phenylethanamine has a molecular weight of 153.20 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-1-phenylethanamine is sourced from PubChem (CID 83815397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).