2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine

C16H20FN3 — CID 79250925

IUPAC2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine
SMILESCNc1ccnc(CN(C)C(C)c2ccccc2F)c1
InChIInChI=1S/C16H20FN3/c1-12(15-6-4-5-7-16(15)17)20(3)11-14-10-13(18-2)8-9-19-14/h4-10,12H,11H2,1-3H3,(H,18,19)
InChIKeyFCHPJPNHNDXACH-UHFFFAOYSA-N
MW273.36 g/mol
LogP3.46
Rot. Bonds5

About 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine

2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine (PubChem CID 79250925) has the molecular formula C16H20FN3 and a molecular weight of 273.36 g/mol. Its IUPAC name is 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine.

Molecular Properties

Compound Name2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine
PubChem CID79250925
Molecular FormulaC16H20FN3
Molecular Weight273.36 g/mol
Exact Mass273.16
IUPAC Name2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine
SMILESCNc1ccnc(CN(C)C(C)c2ccccc2F)c1
InChIInChI=1S/C16H20FN3/c1-12(15-6-4-5-7-16(15)17)20(3)11-14-10-13(18-2)8-9-19-14/h4-10,12H,11H2,1-3H3,(H,18,19)
InChIKeyFCHPJPNHNDXACH-UHFFFAOYSA-N
XLogP3.46
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-chlorophenyl)-N-[(4-chloro-2-pyridinyl)methyl]-N-methylethanamine
CID 79255628
1-(2-fluorophenyl)-N-methyl-N-[[3-(methylaminomethyl)-1,2-oxazol-5-yl]methyl]ethanamine
CID 62984925
1-(2-fluorophenyl)-N-methyl-N-[[2-(methylaminomethyl)phenyl]methyl]ethanamine
CID 62985620
1-(2-fluorophenyl)-N-methyl-N-[[3-(methylaminomethyl)phenyl]methyl]ethanamine
CID 62985100
2-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]pyridin-4-amine
CID 79251856
N-methyl-2-[[2-methylpropyl(propan-2-yl)amino]methyl]pyridin-4-amine
CID 79244227
2-[methyl-[[4-(methylamino)-2-pyridinyl]methyl]amino]-N-propan-2-ylacetamide
CID 79245478
N-[(4-hydrazinyl-2-pyridinyl)methyl]-N-methyl-1-thiophen-2-ylethanamine
CID 79259173
N-[[3-(aminomethyl)-4-fluorophenyl]methyl]-1-(2-fluorophenyl)-N-methylethanamine
CID 107878398
N-methyl-2-[[methyl(thiophen-2-ylmethyl)amino]methyl]pyridin-4-amine
CID 79244648
N-[(3-bromo-4-fluorophenyl)methyl]-1-(2-fluorophenyl)-N-methylethanamine
CID 63457680
4-fluoro-2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]aniline
CID 62980353

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine?
The IUPAC name of 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine (CID 79250925) is 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine.
What is the SMILES notation for 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine?
The canonical SMILES for 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine is CNc1ccnc(CN(C)C(C)c2ccccc2F)c1.
What is the InChIKey of 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine?
The InChIKey is FCHPJPNHNDXACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-12(15-6-4-5-7-16(15)17)20(3)11-14-10-13(18-2)8-9-19-14/h4-10,12H,11H2,1-3H3,(H,18,19).
What are the key properties of 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine?
2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine has a molecular weight of 273.36 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-4-amine is sourced from PubChem (CID 79250925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).