1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine

C15H17FN2S — CID 43188760

IUPAC1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine
SMILESCC(N)c1c(F)cccc1N1CCc2sccc2C1
InChIInChI=1S/C15H17FN2S/c1-10(17)15-12(16)3-2-4-13(15)18-7-5-14-11(9-18)6-8-19-14/h2-4,6,8,10H,5,7,9,17H2,1H3
InChIKeyCGPZVMFVEUZBTQ-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.47
Rot. Bonds2

About 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine

1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine (PubChem CID 43188760) has the molecular formula C15H17FN2S and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine
PubChem CID43188760
Molecular FormulaC15H17FN2S
Molecular Weight276.38 g/mol
Exact Mass276.11
IUPAC Name1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine
SMILESCC(N)c1c(F)cccc1N1CCc2sccc2C1
InChIInChI=1S/C15H17FN2S/c1-10(17)15-12(16)3-2-4-13(15)18-7-5-14-11(9-18)6-8-19-14/h2-4,6,8,10H,5,7,9,17H2,1H3
InChIKeyCGPZVMFVEUZBTQ-UHFFFAOYSA-N
XLogP3.47
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Fluoro-6-[(2-thienylmethyl)amino]benzonitrile
CID 566162
2-[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]-N,N-dimethylaniline
CID 10039780
2-amino-N,N-dimethyl-alpha-(3-methyl-2-thienyl)benzeneethanamine
CID 10061179
(S)-2-(6-Ethylsulfanyl-5-fluoro-2,3-dihydro-indol-1-yl)-1-methyl-ethylamine
CID 44315697
Timelotem
CID 65844
1-(4-Fluorophenyl)-4-[(5-methylthiophen-3-yl)methyl]piperazine
CID 16019107
2-[2-(3-Methylthiophen-2-yl)-2-(propylamino)ethyl]aniline;hydrochloride
CID 45261382
2-[2-(Methylamino)-2-(3-methylthiophen-2-yl)ethyl]aniline;hydrochloride
CID 45261385
2-[2-(Ethylamino)-2-(3-methylthiophen-2-yl)ethyl]aniline;hydrochloride
CID 45261407
N-phenyl-4-propyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 57325593
2-ethyl-N-[[5-[(2-ethylanilino)methyl]thiophen-2-yl]methyl]aniline
CID 155525206
2-methyl-N-[[5-[(2-methylanilino)methyl]thiophen-2-yl]methyl]aniline
CID 155558860

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine?
The IUPAC name of 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine (CID 43188760) is 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine.
What is the SMILES notation for 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine?
The canonical SMILES for 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine is CC(N)c1c(F)cccc1N1CCc2sccc2C1.
What is the InChIKey of 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine?
The InChIKey is CGPZVMFVEUZBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2S/c1-10(17)15-12(16)3-2-4-13(15)18-7-5-14-11(9-18)6-8-19-14/h2-4,6,8,10H,5,7,9,17H2,1H3.
What are the key properties of 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine?
1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine has a molecular weight of 276.38 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-fluorophenyl]ethanamine is sourced from PubChem (CID 43188760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).