1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine

C14H15FN2O — CID 107170649

IUPAC1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cnccc1Oc1ccc(C)c(F)c1
InChIInChI=1S/C14H15FN2O/c1-10-3-4-12(7-13(10)15)18-14-5-6-17-9-11(14)8-16-2/h3-7,9,16H,8H2,1-2H3
InChIKeyFDQABNVYFUZITJ-UHFFFAOYSA-N
MW246.29 g/mol
LogP3.04
Rot. Bonds4

About 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine

1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine (PubChem CID 107170649) has the molecular formula C14H15FN2O and a molecular weight of 246.29 g/mol. Its IUPAC name is 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine
PubChem CID107170649
Molecular FormulaC14H15FN2O
Molecular Weight246.29 g/mol
Exact Mass246.12
IUPAC Name1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cnccc1Oc1ccc(C)c(F)c1
InChIInChI=1S/C14H15FN2O/c1-10-3-4-12(7-13(10)15)18-14-5-6-17-9-11(14)8-16-2/h3-7,9,16H,8H2,1-2H3
InChIKeyFDQABNVYFUZITJ-UHFFFAOYSA-N
XLogP3.04
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[4-fluoro-3-(trifluoromethyl)phenoxy]-3-pyridinyl]-N-methylmethanamine
CID 102747370
N-methyl-1-[4-(3-methyl-4-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81250777
1-[4-(4-chlorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 81250713
1-[4-(2-fluorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 81250426
N-[[3-(3-fluoro-4-methylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 107170646
N-[[4-(3,4-dimethylphenoxy)-3-pyridinyl]methyl]propan-1-amine
CID 81251065
N-[[4-(4-bromo-3-fluorophenoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 81254260
1-[3-[4-fluoro-3-(trifluoromethyl)phenoxy]-4-pyridinyl]-N-methylmethanamine
CID 102747358
1-[5-chloro-2-(4-fluoro-3-methylphenoxy)phenyl]-N-methylmethanamine
CID 114857626
1-[4-[(2-fluorophenyl)methoxy]-3-pyridinyl]-N-methylmethanamine
CID 81251244
1-[4-(3,4-difluorophenoxy)-2-methylphenyl]-N-methylmethanamine
CID 55038504
N-[[4-(4-bromo-3-methylphenoxy)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 83138141

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine (CID 107170649) is 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine is CNCc1cnccc1Oc1ccc(C)c(F)c1.
What is the InChIKey of 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine?
The InChIKey is FDQABNVYFUZITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-10-3-4-12(7-13(10)15)18-14-5-6-17-9-11(14)8-16-2/h3-7,9,16H,8H2,1-2H3.
What are the key properties of 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine?
1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine has a molecular weight of 246.29 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-fluoro-4-methylphenoxy)-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 107170649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).