1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine

C14H15FN2O — CID 54967829

IUPAC1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1cncc(F)c1)c1cccc(OC)c1
InChIInChI=1S/C14H15FN2O/c1-16-14(11-6-12(15)9-17-8-11)10-4-3-5-13(7-10)18-2/h3-9,14,16H,1-2H3
InChIKeyRGHXEKPXJYXGEX-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.54
Rot. Bonds4

About 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine

1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine (PubChem CID 54967829) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine
PubChem CID54967829
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1cncc(F)c1)c1cccc(OC)c1
InChIInChI=1S/C14H15FN2O/c1-16-14(11-6-12(15)9-17-8-11)10-4-3-5-13(7-10)18-2/h3-9,14,16H,1-2H3
InChIKeyRGHXEKPXJYXGEX-UHFFFAOYSA-N
XLogP2.54
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-fluoro-3-pyridinyl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105175369
[(5-fluoro-3-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105191767
1-(5-fluoro-3-pyridinyl)-1-(3-methoxy-4-methylphenyl)-N-methylmethanamine
CID 115804713
[(3-fluorophenyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105193182
1-(2,5-dimethoxyphenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 115805232
1-(5-methoxy-3-pyridinyl)-N-methyl-1-(3-propoxyphenyl)methanamine
CID 105025977
1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 54967877
1-(4-fluoro-3,5-dimethylphenyl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 65299487
1-(3,4-dichlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 81492170
1-(3-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 63156049
1-(2-chloro-5-fluorophenyl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 105394635
1-(4-chloro-3-fluorophenyl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 107991860

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine (CID 54967829) is 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine is CNC(c1cncc(F)c1)c1cccc(OC)c1.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine?
The InChIKey is RGHXEKPXJYXGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-16-14(11-6-12(15)9-17-8-11)10-4-3-5-13(7-10)18-2/h3-9,14,16H,1-2H3.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine?
1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine has a molecular weight of 246.28 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyridinyl)-1-(3-methoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 54967829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).