2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine

C13H18F3N3 — CID 102718696

IUPAC2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine
SMILESCNc1cc(C(F)(F)F)cc(NC2(C)CCCC2)n1
InChIInChI=1S/C13H18F3N3/c1-12(5-3-4-6-12)19-11-8-9(13(14,15)16)7-10(17-2)18-11/h7-8H,3-6H2,1-2H3,(H2,17,18,19)
InChIKeyPAIQMSWNINFJCZ-UHFFFAOYSA-N
MW273.30 g/mol
LogP3.89
Rot. Bonds3

About 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine

2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine (PubChem CID 102718696) has the molecular formula C13H18F3N3 and a molecular weight of 273.30 g/mol. Its IUPAC name is 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine
PubChem CID102718696
Molecular FormulaC13H18F3N3
Molecular Weight273.30 g/mol
Exact Mass273.15
IUPAC Name2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine
SMILESCNc1cc(C(F)(F)F)cc(NC2(C)CCCC2)n1
InChIInChI=1S/C13H18F3N3/c1-12(5-3-4-6-12)19-11-8-9(13(14,15)16)7-10(17-2)18-11/h7-8H,3-6H2,1-2H3,(H2,17,18,19)
InChIKeyPAIQMSWNINFJCZ-UHFFFAOYSA-N
XLogP3.89
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-methyl-6-N-(4-methyloxan-4-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719330
2-N-ethyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718695
6-N-(1-ethylcyclobutyl)-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719321
2-tert-butyl-6-N-methyl-4-N-(1-methylcyclobutyl)pyrimidine-4,6-diamine
CID 113486258
6-chloro-N-(1-methylcyclopentyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106767917
6-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102718440
[1-[[[6-(methylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]methyl]cyclopropyl]methanol
CID 102719028
N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine
CID 102717162
6-N-(2-cyclopentylethyl)-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717681
[1-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]cyclopentyl]methanol
CID 102720689
6-N-[1-(dimethylamino)propan-2-yl]-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719072
6-N-(1-cyclopropylethyl)-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717537

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
The IUPAC name of 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine (CID 102718696) is 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
The canonical SMILES for 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine is CNc1cc(C(F)(F)F)cc(NC2(C)CCCC2)n1.
What is the InChIKey of 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
The InChIKey is PAIQMSWNINFJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F3N3/c1-12(5-3-4-6-12)19-11-8-9(13(14,15)16)7-10(17-2)18-11/h7-8H,3-6H2,1-2H3,(H2,17,18,19).
What are the key properties of 2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
2-N-methyl-6-N-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine has a molecular weight of 273.30 g/mol, XLogP of 3.89, 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-(1-methylcyclopentyl)-4-(trifluoromethyl)pyridine-2,6-diamine is sourced from PubChem (CID 102718696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).