2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine

C14H14F3N3 — CID 80812662

IUPAC2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccc(C)c(C(F)(F)F)c2)n1
InChIInChI=1S/C14H14F3N3/c1-9-6-7-10(8-11(9)14(15,16)17)19-13-5-3-4-12(18-2)20-13/h3-8H,1-2H3,(H2,18,19,20)
InChIKeyUDKCOBPXLZFXPM-UHFFFAOYSA-N
MW281.28 g/mol
LogP4.19
Rot. Bonds3

About 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine

2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine (PubChem CID 80812662) has the molecular formula C14H14F3N3 and a molecular weight of 281.28 g/mol. Its IUPAC name is 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine
PubChem CID80812662
Molecular FormulaC14H14F3N3
Molecular Weight281.28 g/mol
Exact Mass281.11
IUPAC Name2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccc(C)c(C(F)(F)F)c2)n1
InChIInChI=1S/C14H14F3N3/c1-9-6-7-10(8-11(9)14(15,16)17)19-13-5-3-4-12(18-2)20-13/h3-8H,1-2H3,(H2,18,19,20)
InChIKeyUDKCOBPXLZFXPM-UHFFFAOYSA-N
XLogP4.19
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 63588805
6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine
CID 80755260
6-N-methyl-4-N-[4-methyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4,6-triamine
CID 80791340
6-N-(4-bromo-3-methylphenyl)-2-N-methylpyridine-2,6-diamine
CID 80759559
6-hydrazinyl-N-[4-methyl-3-(trifluoromethyl)phenyl]pyrazin-2-amine
CID 80903825
6-chloro-4-N-methyl-2-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4-diamine
CID 80791134
2-N-[4-bromo-3-(trifluoromethyl)phenyl]-6-N-methylpyrazine-2,6-diamine
CID 80840633
2-[4-[[6-(methylamino)-2-pyridinyl]amino]anilino]ethanol
CID 69135632
N-chloro-4-methyl-3-(trifluoromethyl)aniline
CID 162568160
2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine
CID 80755629
4-[(6-chloro-2-pyridinyl)amino]-2-(trifluoromethyl)benzonitrile
CID 65485739
5-[4-methyl-3-(trifluoromethyl)anilino]pyrazine-2-carboxylic acid
CID 107372402

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine?
The IUPAC name of 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine (CID 80812662) is 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine.
What is the SMILES notation for 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine?
The canonical SMILES for 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine is CNc1cccc(Nc2ccc(C)c(C(F)(F)F)c2)n1.
What is the InChIKey of 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine?
The InChIKey is UDKCOBPXLZFXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3/c1-9-6-7-10(8-11(9)14(15,16)17)19-13-5-3-4-12(18-2)20-13/h3-8H,1-2H3,(H2,18,19,20).
What are the key properties of 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine?
2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine has a molecular weight of 281.28 g/mol, XLogP of 4.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine is sourced from PubChem (CID 80812662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).