5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine

C13H15F3N2S — CID 115517514

IUPAC5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
SMILESCNC(CCCC(F)(F)F)c1cnc2ccsc2c1
InChIInChI=1S/C13H15F3N2S/c1-17-10(3-2-5-13(14,15)16)9-7-12-11(18-8-9)4-6-19-12/h4,6-8,10,17H,2-3,5H2,1H3
InChIKeyPROWDIKULYOPSX-UHFFFAOYSA-N
MW288.34 g/mol
LogP4.29
Rot. Bonds5

About 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine

5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine (PubChem CID 115517514) has the molecular formula C13H15F3N2S and a molecular weight of 288.34 g/mol. Its IUPAC name is 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine.

Molecular Properties

Compound Name5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
PubChem CID115517514
Molecular FormulaC13H15F3N2S
Molecular Weight288.34 g/mol
Exact Mass288.09
IUPAC Name5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
SMILESCNC(CCCC(F)(F)F)c1cnc2ccsc2c1
InChIInChI=1S/C13H15F3N2S/c1-17-10(3-2-5-13(14,15)16)9-7-12-11(18-8-9)4-6-19-12/h4,6-8,10,17H,2-3,5H2,1H3
InChIKeyPROWDIKULYOPSX-UHFFFAOYSA-N
XLogP4.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.34
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4,4-trifluoro-N-propyl-1-thieno[3,2-b]pyridin-6-ylbutan-1-amine
CID 81143135
N-methyl-1-thieno[3,2-b]pyridin-6-yl-3-thiophen-3-ylpropan-1-amine
CID 81143798
N,3-dimethyl-1-thieno[3,2-b]pyridin-6-ylhexan-1-amine
CID 81143501
3-ethyl-N-methyl-1-thieno[3,2-b]pyridin-6-ylheptan-1-amine
CID 81143975
2-(4-chlorophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143973
N-methyl-2-(4-methylphenyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143698
N-methyl-2-propoxy-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81144162
2-(4-bromophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143696
1-thieno[3,2-b]pyridin-6-ylethanol
CID 64830910
N-methyl-2-(2-methylphenyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143207
2-(3-chloro-4-fluorophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 103040348
2-(2-chloro-5-fluorophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 102619203

Frequently Asked Questions

What is the IUPAC name of 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
The IUPAC name of 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine (CID 115517514) is 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine.
What is the SMILES notation for 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
The canonical SMILES for 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine is CNC(CCCC(F)(F)F)c1cnc2ccsc2c1.
What is the InChIKey of 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
The InChIKey is PROWDIKULYOPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2S/c1-17-10(3-2-5-13(14,15)16)9-7-12-11(18-8-9)4-6-19-12/h4,6-8,10,17H,2-3,5H2,1H3.
What are the key properties of 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine has a molecular weight of 288.34 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,5-trifluoro-N-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine is sourced from PubChem (CID 115517514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).