2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine

C13H13NOS2 — CID 105029930

IUPAC2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
SMILESCNC(Cc1ccoc1)c1cc2sccc2s1
InChIInChI=1S/C13H13NOS2/c1-14-10(6-9-2-4-15-8-9)12-7-13-11(17-12)3-5-16-13/h2-5,7-8,10,14H,6H2,1H3
InChIKeyRHBCXMIKNADDIO-UHFFFAOYSA-N
MW263.39 g/mol
LogP4.06
Rot. Bonds4

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

2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine (PubChem CID 105029930) has the molecular formula C13H13NOS2 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
PubChem CID105029930
Molecular FormulaC13H13NOS2
Molecular Weight263.39 g/mol
Exact Mass263.04
IUPAC Name2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
SMILESCNC(Cc1ccoc1)c1cc2sccc2s1
InChIInChI=1S/C13H13NOS2/c1-14-10(6-9-2-4-15-8-9)12-7-13-11(17-12)3-5-16-13/h2-5,7-8,10,14H,6H2,1H3
InChIKeyRHBCXMIKNADDIO-UHFFFAOYSA-N
XLogP4.06
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105034571
2-(3-bromothiophen-2-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115848986
2-(3-bromo-4-fluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115818614
2-(furan-3-yl)-1-(4-methoxythiophen-2-yl)-N-methylethanamine
CID 105030240
2-(2,3-difluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 80744894
2-(furan-3-yl)-N-methyl-1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)ethanamine
CID 105030057
2-(5-chloro-2-fluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 103053200
2-(2,5-difluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115809913
N-methyl-1-thieno[3,2-b]thiophen-5-ylnonan-1-amine
CID 115835455
N-methyl-4-phenyl-1-thieno[3,2-b]thiophen-5-ylbutan-1-amine
CID 115849469
1-(2,5-dibromothiophen-3-yl)-2-(furan-3-yl)-N-methylethanamine
CID 107968943
3-cyclopropyl-N-methyl-1-thieno[3,2-b]thiophen-5-ylpropan-1-amine
CID 104994963

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine?
The IUPAC name of 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine (CID 105029930) is 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine.
What is the SMILES notation for 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine?
The canonical SMILES for 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine is CNC(Cc1ccoc1)c1cc2sccc2s1.
What is the InChIKey of 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine?
The InChIKey is RHBCXMIKNADDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NOS2/c1-14-10(6-9-2-4-15-8-9)12-7-13-11(17-12)3-5-16-13/h2-5,7-8,10,14H,6H2,1H3.
What are the key properties of 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine?
2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine has a molecular weight of 263.39 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine is sourced from PubChem (CID 105029930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).