1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine

C15H17FN2 — CID 79713610

IUPAC1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
SMILESCNC(c1ccc(C)c(C)c1)c1ccc(F)cn1
InChIInChI=1S/C15H17FN2/c1-10-4-5-12(8-11(10)2)15(17-3)14-7-6-13(16)9-18-14/h4-9,15,17H,1-3H3
InChIKeyXHFCERKSGLJMDW-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.15
Rot. Bonds3

About 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine

1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine (PubChem CID 79713610) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
PubChem CID79713610
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
SMILESCNC(c1ccc(C)c(C)c1)c1ccc(F)cn1
InChIInChI=1S/C15H17FN2/c1-10-4-5-12(8-11(10)2)15(17-3)14-7-6-13(16)9-18-14/h4-9,15,17H,1-3H3
InChIKeyXHFCERKSGLJMDW-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

Analyze 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine 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-(4-fluorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712823
1-(4-chlorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712635
[(3-chloro-4-methylphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
CID 107562414
1-(5-fluoro-2-pyridinyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 79712254
1-(5-fluoro-2-pyridinyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 79712824
N-[1-(5-fluoro-2-pyridinyl)ethyl]-3,4-dimethylaniline
CID 83117825
1-(2-chloro-5-fluorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 105395258
1-(4-fluorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105087924
1-(5-fluoro-2-pyridinyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 79713609
1-(5-fluoro-2-pyridinyl)-N-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]methanamine
CID 102754677
[(3,4-difluorophenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
CID 105248376
1-(2,6-difluorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712535

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine (CID 79713610) is 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine is CNC(c1ccc(C)c(C)c1)c1ccc(F)cn1.
What is the InChIKey of 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine?
The InChIKey is XHFCERKSGLJMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-10-4-5-12(8-11(10)2)15(17-3)14-7-6-13(16)9-18-14/h4-9,15,17H,1-3H3.
What are the key properties of 1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine?
1-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine 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-(3,4-dimethylphenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 79713610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).