6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

C13H18F3N3 — CID 102718440

IUPAC6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(N2CCCC2(C)C)n1
InChIInChI=1S/C13H18F3N3/c1-12(2)5-4-6-19(12)11-8-9(13(14,15)16)7-10(17-3)18-11/h7-8H,4-6H2,1-3H3,(H,17,18)
InChIKeyLWQRUUORAWZODG-UHFFFAOYSA-N
MW273.30 g/mol
LogP3.52
Rot. Bonds2

About 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102718440) has the molecular formula C13H18F3N3 and a molecular weight of 273.30 g/mol. Its IUPAC name is 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102718440
Molecular FormulaC13H18F3N3
Molecular Weight273.30 g/mol
Exact Mass273.15
IUPAC Name6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(N2CCCC2(C)C)n1
InChIInChI=1S/C13H18F3N3/c1-12(2)5-4-6-19(12)11-8-9(13(14,15)16)7-10(17-3)18-11/h7-8H,4-6H2,1-3H3,(H,17,18)
InChIKeyLWQRUUORAWZODG-UHFFFAOYSA-N
XLogP3.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine
CID 102717162
2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718696
6-(3,5-diethylpyrazol-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719620
N-methyl-6-(2-propan-2-ylpyrrolidin-1-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102718789
6-N-(1-ethylcyclobutyl)-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719321
4-(2,2-dimethylpyrrolidin-1-yl)-N-propyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114565002
6-(2,6-dimethylmorpholin-4-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102717181
6-(2,5-dimethylmorpholin-4-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102717555
6-(3-methoxypyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 103541738
2-N-methyl-6-N-(4-methyloxan-4-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719330
2-N-methyl-6-N-morpholin-4-yl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719094
[1-[[[6-(methylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]methyl]cyclopropyl]methanol
CID 102719028

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (CID 102718440) is 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(N2CCCC2(C)C)n1.
What is the InChIKey of 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is LWQRUUORAWZODG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F3N3/c1-12(2)5-4-6-19(12)11-8-9(13(14,15)16)7-10(17-3)18-11/h7-8H,4-6H2,1-3H3,(H,17,18).
What are the key properties of 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 273.30 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102718440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).