N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine

C14H14F3N3 — CID 105173821

IUPACN-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
SMILESCNC(c1cncc(C)c1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H14F3N3/c1-9-5-10(7-19-6-9)13(18-2)12-4-3-11(8-20-12)14(15,16)17/h3-8,13,18H,1-2H3
InChIKeyITRWLTJGFFEMLN-UHFFFAOYSA-N
MW281.28 g/mol
LogP3.11
Rot. Bonds3

About N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine

N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine (PubChem CID 105173821) has the molecular formula C14H14F3N3 and a molecular weight of 281.28 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
PubChem CID105173821
Molecular FormulaC14H14F3N3
Molecular Weight281.28 g/mol
Exact Mass281.11
IUPAC NameN-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
SMILESCNC(c1cncc(C)c1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H14F3N3/c1-9-5-10(7-19-6-9)13(18-2)12-4-3-11(8-20-12)14(15,16)17/h3-8,13,18H,1-2H3
InChIKeyITRWLTJGFFEMLN-UHFFFAOYSA-N
XLogP3.11
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105087924
[(5-methoxy-3-pyridinyl)-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105329743
1-(5-fluoro-2-pyridinyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 79712254
N-methyl-1-(5-methyl-3-pyridinyl)-1-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102709913
1-(2,3-dimethylphenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105140563
1-(2-fluorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105119403
1-(2-chlorophenyl)-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105099537
1-(5-fluoro-2-pyridinyl)-N-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]methanamine
CID 102754677
N-methyl-1-(5-methyl-3-pyridinyl)-1-phenylmethanamine
CID 115374320
[[2-fluoro-5-(trifluoromethyl)phenyl]-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105250235
1-(3,4-difluorophenyl)-N-methyl-1-(5-methyl-3-pyridinyl)methanamine
CID 115374301
[pyridin-3-yl-[5-(trifluoromethyl)-2-pyridinyl]methyl]hydrazine
CID 105287046

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine (CID 105173821) is N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine is CNC(c1cncc(C)c1)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
The InChIKey is ITRWLTJGFFEMLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3/c1-9-5-10(7-19-6-9)13(18-2)12-4-3-11(8-20-12)14(15,16)17/h3-8,13,18H,1-2H3.
What are the key properties of N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine has a molecular weight of 281.28 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-3-pyridinyl)-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine is sourced from PubChem (CID 105173821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).