1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine

C9H9FN2S2 — CID 130594678

IUPAC1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
SMILESNC(Cc1nccs1)c1sccc1F
InChIInChI=1S/C9H9FN2S2/c10-6-1-3-14-9(6)7(11)5-8-12-2-4-13-8/h1-4,7H,5,11H2
InChIKeyWRBDOJOTNYDGFY-UHFFFAOYSA-N
MW228.32 g/mol
LogP2.59
Rot. Bonds3

About 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine

1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine (PubChem CID 130594678) has the molecular formula C9H9FN2S2 and a molecular weight of 228.32 g/mol. Its IUPAC name is 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
PubChem CID130594678
Molecular FormulaC9H9FN2S2
Molecular Weight228.32 g/mol
Exact Mass228.02
IUPAC Name1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
SMILESNC(Cc1nccs1)c1sccc1F
InChIInChI=1S/C9H9FN2S2/c10-6-1-3-14-9(6)7(11)5-8-12-2-4-13-8/h1-4,7H,5,11H2
InChIKeyWRBDOJOTNYDGFY-UHFFFAOYSA-N
XLogP2.59
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-fluoro-4-methylphenyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 105015089
1-(5-bromo-2-fluorophenyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 114894483
(1S)-1-(3-fluorothiophen-2-yl)propan-1-amine
CID 130691935
1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 105014977
2-(1,3-thiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105169295
2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105015351
1-[2-bromo-5-(trifluoromethyl)phenyl]-2-(1,3-thiazol-2-yl)ethanamine
CID 105014893
1-(4-bromo-2-methylphenyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 105014989
3-methyl-3-phenyl-1-(1,3-thiazol-2-yl)butan-2-amine
CID 79824374
1-(3-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
CID 115822545
3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-amine
CID 105015255
1-(3-methoxyphenyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 79020836

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine (CID 130594678) is 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine is NC(Cc1nccs1)c1sccc1F.
What is the InChIKey of 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
The InChIKey is WRBDOJOTNYDGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2S2/c10-6-1-3-14-9(6)7(11)5-8-12-2-4-13-8/h1-4,7H,5,11H2.
What are the key properties of 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine?
1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine has a molecular weight of 228.32 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 130594678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).