3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine

C10H13F3N2O — CID 103182970

IUPAC3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine
SMILESCc1cnc(COCC(F)(F)F)c(C)c1N
InChIInChI=1S/C10H13F3N2O/c1-6-3-15-8(7(2)9(6)14)4-16-5-10(11,12)13/h3H,4-5H2,1-2H3,(H2,14,15)
InChIKeyUZFPHRXXSGWKEV-UHFFFAOYSA-N
MW234.22 g/mol
LogP2.36
Rot. Bonds3

About 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine

3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine (PubChem CID 103182970) has the molecular formula C10H13F3N2O and a molecular weight of 234.22 g/mol. Its IUPAC name is 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine
PubChem CID103182970
Molecular FormulaC10H13F3N2O
Molecular Weight234.22 g/mol
Exact Mass234.10
IUPAC Name3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine
SMILESCc1cnc(COCC(F)(F)F)c(C)c1N
InChIInChI=1S/C10H13F3N2O/c1-6-3-15-8(7(2)9(6)14)4-16-5-10(11,12)13/h3H,4-5H2,1-2H3,(H2,14,15)
InChIKeyUZFPHRXXSGWKEV-UHFFFAOYSA-N
XLogP2.36
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine?
The IUPAC name of 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine (CID 103182970) is 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine.
What is the SMILES notation for 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine?
The canonical SMILES for 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine is Cc1cnc(COCC(F)(F)F)c(C)c1N.
What is the InChIKey of 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine?
The InChIKey is UZFPHRXXSGWKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2O/c1-6-3-15-8(7(2)9(6)14)4-16-5-10(11,12)13/h3H,4-5H2,1-2H3,(H2,14,15).
What are the key properties of 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine?
3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine has a molecular weight of 234.22 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-(2,2,2-trifluoroethoxymethyl)pyridin-4-amine is sourced from PubChem (CID 103182970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).