2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine

C14H19FN2 — CID 114462445

IUPAC2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
SMILESCC1=CCN(C(CN)c2ccccc2F)CC1
InChIInChI=1S/C14H19FN2/c1-11-6-8-17(9-7-11)14(10-16)12-4-2-3-5-13(12)15/h2-6,14H,7-10,16H2,1H3
InChIKeyGMOFKEOGLDSZCJ-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.48
Rot. Bonds3

About 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine

2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine (PubChem CID 114462445) has the molecular formula C14H19FN2 and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
PubChem CID114462445
Molecular FormulaC14H19FN2
Molecular Weight234.32 g/mol
Exact Mass234.15
IUPAC Name2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
SMILESCC1=CCN(C(CN)c2ccccc2F)CC1
InChIInChI=1S/C14H19FN2/c1-11-6-8-17(9-7-11)14(10-16)12-4-2-3-5-13(12)15/h2-6,14H,7-10,16H2,1H3
InChIKeyGMOFKEOGLDSZCJ-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluorophenyl)-2-(4-propan-2-ylpiperazin-1-yl)ethanamine
CID 43585183
2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-2-(3-methylthiophen-2-yl)ethanamine
CID 114462344
2-(2-fluorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
CID 102742921
2-(3-ethyl-4-methylpiperazin-1-yl)-2-(2-fluorophenyl)ethanamine
CID 63603473
2-(2-bromophenyl)-2-(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
CID 114462097
2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 62136658
2-(2-fluorophenyl)-2-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)ethanamine
CID 81199156
2-(2,3-difluorophenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 63669105
2-(2-ethylpyrrolidin-1-yl)-2-(2-fluorophenyl)ethanamine
CID 60974674
2-(3,5-dimethylpyrazol-1-yl)-2-(2-fluorophenyl)ethanamine
CID 55018981
2-(2-fluorophenyl)-2-(3-methylmorpholin-4-yl)ethanamine
CID 43541859
2-(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)-2-(5-methylfuran-2-yl)ethanamine
CID 114462186

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
The IUPAC name of 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine (CID 114462445) is 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine is CC1=CCN(C(CN)c2ccccc2F)CC1.
What is the InChIKey of 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
The InChIKey is GMOFKEOGLDSZCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2/c1-11-6-8-17(9-7-11)14(10-16)12-4-2-3-5-13(12)15/h2-6,14H,7-10,16H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine has a molecular weight of 234.32 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine is sourced from PubChem (CID 114462445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).