N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine

C11H9F3N2S — CID 82810835

IUPACN-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine
SMILESFC(F)(F)c1ccc(NCc2ccsc2)cn1
InChIInChI=1S/C11H9F3N2S/c12-11(13,14)10-2-1-9(6-16-10)15-5-8-3-4-17-7-8/h1-4,6-7,15H,5H2
InChIKeyKXIGSHZDTSNIKU-UHFFFAOYSA-N
MW258.27 g/mol
LogP3.77
Rot. Bonds3

About N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine

N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 82810835) has the molecular formula C11H9F3N2S and a molecular weight of 258.27 g/mol. Its IUPAC name is N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine
PubChem CID82810835
Molecular FormulaC11H9F3N2S
Molecular Weight258.27 g/mol
Exact Mass258.04
IUPAC NameN-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine
SMILESFC(F)(F)c1ccc(NCc2ccsc2)cn1
InChIInChI=1S/C11H9F3N2S/c12-11(13,14)10-2-1-9(6-16-10)15-5-8-3-4-17-7-8/h1-4,6-7,15H,5H2
InChIKeyKXIGSHZDTSNIKU-UHFFFAOYSA-N
XLogP3.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-thiazol-4-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine
CID 82810952
5-(thiophen-3-ylmethylamino)pyridine-2-carbonitrile
CID 79840154
N-[(3,4-dimethylphenyl)methyl]-6-(trifluoromethyl)pyridin-3-amine
CID 82811109
N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-2-amine
CID 62315277
N-[(2,6-difluorophenyl)methyl]-6-(trifluoromethyl)pyridin-3-amine
CID 82811102
3-bromo-N-(thiophen-3-ylmethyl)-5-(trifluoromethyl)aniline
CID 65489410
N-[(5-tert-butylthiophen-2-yl)methyl]-6-(trifluoromethyl)pyridin-3-amine
CID 82794611
4-phenyl-N-(thiophen-3-ylmethyl)aniline
CID 43716853
4-(chloromethyl)-N-(thiophen-3-ylmethyl)aniline
CID 65025400
[5-[[[6-(trifluoromethyl)-3-pyridinyl]amino]methyl]furan-2-yl]methanol
CID 82811906
4-(difluoromethylsulfanyl)-N-(thiophen-3-ylmethyl)aniline
CID 43673080
4-(1H-imidazol-5-yl)-N-(thiophen-3-ylmethyl)aniline
CID 43722426

Frequently Asked Questions

What is the IUPAC name of N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine (CID 82810835) is N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine is FC(F)(F)c1ccc(NCc2ccsc2)cn1.
What is the InChIKey of N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is KXIGSHZDTSNIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2S/c12-11(13,14)10-2-1-9(6-16-10)15-5-8-3-4-17-7-8/h1-4,6-7,15H,5H2.
What are the key properties of N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine?
N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 258.27 g/mol, XLogP of 3.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 82810835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).