N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine

C12H11F3N2OS — CID 102719938

IUPACN-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(OCc2cccs2)n1
InChIInChI=1S/C12H11F3N2OS/c1-16-10-5-8(12(13,14)15)6-11(17-10)18-7-9-3-2-4-19-9/h2-6H,7H2,1H3,(H,16,17)
InChIKeyGNOUFFPJLXMQLU-UHFFFAOYSA-N
MW288.29 g/mol
LogP3.78
Rot. Bonds4

About N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine

N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102719938) has the molecular formula C12H11F3N2OS and a molecular weight of 288.29 g/mol. Its IUPAC name is N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102719938
Molecular FormulaC12H11F3N2OS
Molecular Weight288.29 g/mol
Exact Mass288.05
IUPAC NameN-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(OCc2cccs2)n1
InChIInChI=1S/C12H11F3N2OS/c1-16-10-5-8(12(13,14)15)6-11(17-10)18-7-9-3-2-4-19-9/h2-6H,7H2,1H3,(H,16,17)
InChIKeyGNOUFFPJLXMQLU-UHFFFAOYSA-N
XLogP3.78
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.29
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine (CID 102719938) is N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(OCc2cccs2)n1.
What is the InChIKey of N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is GNOUFFPJLXMQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2OS/c1-16-10-5-8(12(13,14)15)6-11(17-10)18-7-9-3-2-4-19-9/h2-6H,7H2,1H3,(H,16,17).
What are the key properties of N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 288.29 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102719938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).