N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine

C12H15F3N2 — CID 113488892

IUPACN-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCCC1(Nc2ccc(C(F)(F)F)cn2)CCC1
InChIInChI=1S/C12H15F3N2/c1-2-11(6-3-7-11)17-10-5-4-9(8-16-10)12(13,14)15/h4-5,8H,2-3,6-7H2,1H3,(H,16,17)
InChIKeyJMUBFNOHEYTGPS-UHFFFAOYSA-N
MW244.26 g/mol
LogP3.85
Rot. Bonds3

About N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine

N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 113488892) has the molecular formula C12H15F3N2 and a molecular weight of 244.26 g/mol. Its IUPAC name is N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID113488892
Molecular FormulaC12H15F3N2
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC NameN-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCCC1(Nc2ccc(C(F)(F)F)cn2)CCC1
InChIInChI=1S/C12H15F3N2/c1-2-11(6-3-7-11)17-10-5-4-9(8-16-10)12(13,14)15/h4-5,8H,2-3,6-7H2,1H3,(H,16,17)
InChIKeyJMUBFNOHEYTGPS-UHFFFAOYSA-N
XLogP3.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-N-(1-ethylcyclobutyl)-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719321
1-[[[5-(trifluoromethyl)-2-pyridinyl]amino]methyl]cyclobutan-1-ol
CID 115669125
N-(1-ethylcyclobutyl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 104938275
N-(2-ethylsulfanylcyclopentyl)-5-(trifluoromethyl)pyridin-2-amine
CID 103804882
[5-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 1477642
5-tert-butyl-N-[1-(trifluoromethyl)cyclopropyl]pyridin-2-amine
CID 106215052
N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 63540704
N-(2-methylbutyl)-5-(trifluoromethyl)pyridin-2-amine
CID 62693316
N-(1-ethylcyclobutyl)-2-fluoro-5-(trifluoromethyl)benzamide
CID 115697230
N-(2,2-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 79870374
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-5-(trifluoromethyl)pyridin-2-amine
CID 28819878
N-(2-methoxyethyl)-N'-[5-(trifluoromethyl)-2-pyridinyl]ethane-1,2-diamine
CID 83038922

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine (CID 113488892) is N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine is CCC1(Nc2ccc(C(F)(F)F)cn2)CCC1.
What is the InChIKey of N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is JMUBFNOHEYTGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2/c1-2-11(6-3-7-11)17-10-5-4-9(8-16-10)12(13,14)15/h4-5,8H,2-3,6-7H2,1H3,(H,16,17).
What are the key properties of N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 244.26 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylcyclobutyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 113488892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).