1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine

C15H17FN2 — CID 79705576

IUPAC1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
SMILESCNC(c1cc(C)cc(F)c1)c1cc(C)ccn1
InChIInChI=1S/C15H17FN2/c1-10-4-5-18-14(8-10)15(17-3)12-6-11(2)7-13(16)9-12/h4-9,15,17H,1-3H3
InChIKeyOOCDFVQAGFHLNV-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.15
Rot. Bonds3

About 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine

1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine (PubChem CID 79705576) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
PubChem CID79705576
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
SMILESCNC(c1cc(C)cc(F)c1)c1cc(C)ccn1
InChIInChI=1S/C15H17FN2/c1-10-4-5-18-14(8-10)15(17-3)12-6-11(2)7-13(16)9-12/h4-9,15,17H,1-3H3
InChIKeyOOCDFVQAGFHLNV-UHFFFAOYSA-N
XLogP3.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-dimethylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 55257537
[(4-fluorophenyl)-(4-methyl-2-pyridinyl)methyl]hydrazine
CID 105219993
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 79704486
1-(3,4-dimethoxyphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 63840394
1-(4-bromophenyl)-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 79704481
1-(7-fluoro-1-benzofuran-2-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 114728621
1-(5-chlorofuran-2-yl)-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 106692700
1-(2,3-dimethylimidazol-4-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 114283414
1-(3-bromofuran-2-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 63942858
[(4-fluoro-2-methylphenyl)-(4-methyl-2-pyridinyl)methyl]hydrazine
CID 105219921
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 102651549
1-(3,5-difluorophenyl)-1-isoquinolin-1-yl-N-methylmethanamine
CID 63948041

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
The IUPAC name of 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine (CID 79705576) is 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
The canonical SMILES for 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine is CNC(c1cc(C)cc(F)c1)c1cc(C)ccn1.
What is the InChIKey of 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
The InChIKey is OOCDFVQAGFHLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-10-4-5-18-14(8-10)15(17-3)12-6-11(2)7-13(16)9-12/h4-9,15,17H,1-3H3.
What are the key properties of 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine has a molecular weight of 244.31 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 79705576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).