2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine

C11H10N2S3 — CID 105015351

IUPAC2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
SMILESNC(Cc1nccs1)c1cc2sccc2s1
InChIInChI=1S/C11H10N2S3/c12-7(5-11-13-2-4-15-11)9-6-10-8(16-9)1-3-14-10/h1-4,6-7H,5,12H2
InChIKeyXMRSDGNATUPUNT-UHFFFAOYSA-N
MW266.42 g/mol
LogP3.66
Rot. Bonds3

About 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine

2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine (PubChem CID 105015351) has the molecular formula C11H10N2S3 and a molecular weight of 266.42 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
PubChem CID105015351
Molecular FormulaC11H10N2S3
Molecular Weight266.42 g/mol
Exact Mass266.00
IUPAC Name2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
SMILESNC(Cc1nccs1)c1cc2sccc2s1
InChIInChI=1S/C11H10N2S3/c12-7(5-11-13-2-4-15-11)9-6-10-8(16-9)1-3-14-10/h1-4,6-7H,5,12H2
InChIKeyXMRSDGNATUPUNT-UHFFFAOYSA-N
XLogP3.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.42
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1H-imidazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 80733712
2-(1,3-benzothiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 80738576
2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105034758
2-(2,6-dichlorophenyl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115830695
2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 112655417
2-ethoxy-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105008209
1-(5-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 105014977
2-(2-chlorophenyl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 80745793
2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105000137
1-thieno[3,2-b]thiophen-5-yl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 80738455
3-methylsulfonyl-1-thieno[3,2-b]thiophen-5-ylpropan-1-amine
CID 115848689
4,4,4-trifluoro-1-thieno[3,2-b]thiophen-5-ylbutan-1-amine
CID 104992946

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine?
The IUPAC name of 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine (CID 105015351) is 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine?
The canonical SMILES for 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine is NC(Cc1nccs1)c1cc2sccc2s1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine?
The InChIKey is XMRSDGNATUPUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2S3/c12-7(5-11-13-2-4-15-11)9-6-10-8(16-9)1-3-14-10/h1-4,6-7H,5,12H2.
What are the key properties of 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine?
2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine has a molecular weight of 266.42 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]thiophen-5-ylethanamine is sourced from PubChem (CID 105015351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).