N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine

C11H15F3N2 — CID 133276838

IUPACN-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)CN(C)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C11H15F3N2/c1-8(2)7-16(3)10-5-4-9(6-15-10)11(12,13)14/h4-6,8H,7H2,1-3H3
InChIKeyNAAUMXRGKAMDCA-UHFFFAOYSA-N
MW232.25 g/mol
LogP3.19
Rot. Bonds3

About N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine

N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 133276838) has the molecular formula C11H15F3N2 and a molecular weight of 232.25 g/mol. Its IUPAC name is N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID133276838
Molecular FormulaC11H15F3N2
Molecular Weight232.25 g/mol
Exact Mass232.12
IUPAC NameN-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)CN(C)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C11H15F3N2/c1-8(2)7-16(3)10-5-4-9(6-15-10)11(12,13)14/h4-6,8H,7H2,1-3H3
InChIKeyNAAUMXRGKAMDCA-UHFFFAOYSA-N
XLogP3.19
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine (CID 133276838) is N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine is CC(C)CN(C)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is NAAUMXRGKAMDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2/c1-8(2)7-16(3)10-5-4-9(6-15-10)11(12,13)14/h4-6,8H,7H2,1-3H3.
What are the key properties of N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine?
N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 232.25 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylpropyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 133276838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).