N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine

C14H14N2S2 — CID 105034571

IUPACN-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
SMILESCNC(Cc1cccnc1)c1cc2sccc2s1
InChIInChI=1S/C14H14N2S2/c1-15-11(7-10-3-2-5-16-9-10)13-8-14-12(18-13)4-6-17-14/h2-6,8-9,11,15H,7H2,1H3
InChIKeyKQSAPMTYRDIIPN-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.86
Rot. Bonds4

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

N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine (PubChem CID 105034571) has the molecular formula C14H14N2S2 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
PubChem CID105034571
Molecular FormulaC14H14N2S2
Molecular Weight274.41 g/mol
Exact Mass274.06
IUPAC NameN-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
SMILESCNC(Cc1cccnc1)c1cc2sccc2s1
InChIInChI=1S/C14H14N2S2/c1-15-11(7-10-3-2-5-16-9-10)13-8-14-12(18-13)4-6-17-14/h2-6,8-9,11,15H,7H2,1H3
InChIKeyKQSAPMTYRDIIPN-UHFFFAOYSA-N
XLogP3.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105034758
1-(6-fluoro-1-benzothiophen-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 105034716
N-methyl-2-pyridin-3-yl-1-(1,3-thiazol-5-yl)ethanamine
CID 104736641
2-(furan-3-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 105029930
2-(3-bromothiophen-2-yl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115848986
N-methyl-4-phenyl-1-thieno[3,2-b]thiophen-5-ylbutan-1-amine
CID 115849469
2-(3-bromo-4-fluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115818614
N-methyl-1-(5-methylthiophen-3-yl)-2-pyridin-3-ylethanamine
CID 65104741
2-(2,3-difluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 80744894
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-2-pyridin-3-yl-1-(2,4,5-trimethylphenyl)ethanamine
CID 64990106

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine?
The IUPAC name of N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine (CID 105034571) is N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine.
What is the SMILES notation for N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine?
The canonical SMILES for N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine is CNC(Cc1cccnc1)c1cc2sccc2s1.
What is the InChIKey of N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine?
The InChIKey is KQSAPMTYRDIIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2S2/c1-15-11(7-10-3-2-5-16-9-10)13-8-14-12(18-13)4-6-17-14/h2-6,8-9,11,15H,7H2,1H3.
What are the key properties of N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine?
N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine has a molecular weight of 274.41 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-3-yl-1-thieno[3,2-b]thiophen-5-ylethanamine is sourced from PubChem (CID 105034571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).