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

C11H9F3N2OS — CID 102719937

IUPAC6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESNc1cc(C(F)(F)F)cc(OCc2cccs2)n1
InChIInChI=1S/C11H9F3N2OS/c12-11(13,14)7-4-9(15)16-10(5-7)17-6-8-2-1-3-18-8/h1-5H,6H2,(H2,15,16)
InChIKeySNERLFIAPIEPOB-UHFFFAOYSA-N
MW274.27 g/mol
LogP3.32
Rot. Bonds3

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

6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102719937) has the molecular formula C11H9F3N2OS and a molecular weight of 274.27 g/mol. Its IUPAC name is 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102719937
Molecular FormulaC11H9F3N2OS
Molecular Weight274.27 g/mol
Exact Mass274.04
IUPAC Name6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESNc1cc(C(F)(F)F)cc(OCc2cccs2)n1
InChIInChI=1S/C11H9F3N2OS/c12-11(13,14)7-4-9(15)16-10(5-7)17-6-8-2-1-3-18-8/h1-5H,6H2,(H2,15,16)
InChIKeySNERLFIAPIEPOB-UHFFFAOYSA-N
XLogP3.32
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine (CID 102719937) is 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine is Nc1cc(C(F)(F)F)cc(OCc2cccs2)n1.
What is the InChIKey of 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is SNERLFIAPIEPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2OS/c12-11(13,14)7-4-9(15)16-10(5-7)17-6-8-2-1-3-18-8/h1-5H,6H2,(H2,15,16).
What are the key properties of 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine?
6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 274.27 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102719937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).