N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine

C15H17FN2O — CID 105075869

IUPACN-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine
SMILESCCNCc1ccncc1Oc1ccc(F)c(C)c1
InChIInChI=1S/C15H17FN2O/c1-3-17-9-12-6-7-18-10-15(12)19-13-4-5-14(16)11(2)8-13/h4-8,10,17H,3,9H2,1-2H3
InChIKeyLSHHHLHLFBYOOM-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.43
Rot. Bonds5

About N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine

N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine (PubChem CID 105075869) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine
PubChem CID105075869
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC NameN-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine
SMILESCCNCc1ccncc1Oc1ccc(F)c(C)c1
InChIInChI=1S/C15H17FN2O/c1-3-17-9-12-6-7-18-10-15(12)19-13-4-5-14(16)11(2)8-13/h4-8,10,17H,3,9H2,1-2H3
InChIKeyLSHHHLHLFBYOOM-UHFFFAOYSA-N
XLogP3.43
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine 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

N-[[3-(3,4-dimethylphenoxy)-4-pyridinyl]methyl]propan-1-amine
CID 105075308
N-[[3-(4-chloro-2-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075441
N-[[3-(3-fluoro-4-methylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 107170646
N-[[3-(3-ethoxyphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075595
N-[[3-(4-propoxyphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075483
N-[[3-(2-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075332
N-[[3-(1-methylpyrazol-4-yl)oxy-4-pyridinyl]methyl]ethanamine
CID 105075984
1-[3-[4-fluoro-3-(trifluoromethyl)phenoxy]-4-pyridinyl]-N-methylmethanamine
CID 102747358
N-[[3-(2,4,5-trichlorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075180
N-[[3-(2-bromo-4-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075462
N-[[4-(3,4-dimethylphenoxy)-3-pyridinyl]methyl]propan-1-amine
CID 81251065
[3-(3,4-dimethylphenoxy)-4-pyridinyl]methanamine
CID 59112975

Frequently Asked Questions

What is the IUPAC name of N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine (CID 105075869) is N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine is CCNCc1ccncc1Oc1ccc(F)c(C)c1.
What is the InChIKey of N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine?
The InChIKey is LSHHHLHLFBYOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-3-17-9-12-6-7-18-10-15(12)19-13-4-5-14(16)11(2)8-13/h4-8,10,17H,3,9H2,1-2H3.
What are the key properties of N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine?
N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine has a molecular weight of 260.31 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(4-fluoro-3-methylphenoxy)-4-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 105075869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).