1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine

C9H10N2S2 — CID 62091887

IUPAC1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine
SMILESCC(N)c1nc(-c2ccsc2)cs1
InChIInChI=1S/C9H10N2S2/c1-6(10)9-11-8(5-13-9)7-2-3-12-4-7/h2-6H,10H2,1H3
InChIKeySDDANYMFXMROGK-UHFFFAOYSA-N
MW210.33 g/mol
LogP2.89
Rot. Bonds2

About 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine

1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine (PubChem CID 62091887) has the molecular formula C9H10N2S2 and a molecular weight of 210.33 g/mol. Its IUPAC name is 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine
PubChem CID62091887
Molecular FormulaC9H10N2S2
Molecular Weight210.33 g/mol
Exact Mass210.03
IUPAC Name1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine
SMILESCC(N)c1nc(-c2ccsc2)cs1
InChIInChI=1S/C9H10N2S2/c1-6(10)9-11-8(5-13-9)7-2-3-12-4-7/h2-6H,10H2,1H3
InChIKeySDDANYMFXMROGK-UHFFFAOYSA-N
XLogP2.89
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine (CID 62091887) is 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine is CC(N)c1nc(-c2ccsc2)cs1.
What is the InChIKey of 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine?
The InChIKey is SDDANYMFXMROGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S2/c1-6(10)9-11-8(5-13-9)7-2-3-12-4-7/h2-6H,10H2,1H3.
What are the key properties of 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine?
1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine has a molecular weight of 210.33 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-thiophen-3-yl-1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 62091887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).