2-thiophen-2-ylthiophen-3-amine

C8H7NS2 — CID 12765253

IUPAC2-thiophen-2-ylthiophen-3-amine
SMILESNc1ccsc1-c1cccs1
InChIInChI=1S/C8H7NS2/c9-6-3-5-11-8(6)7-2-1-4-10-7/h1-5H,9H2
InChIKeyALVRMRYUXMLYKV-UHFFFAOYSA-N
MW181.29 g/mol
LogP3.06
Rot. Bonds1

About 2-thiophen-2-ylthiophen-3-amine

2-thiophen-2-ylthiophen-3-amine (PubChem CID 12765253) has the molecular formula C8H7NS2 and a molecular weight of 181.29 g/mol. Its IUPAC name is 2-thiophen-2-ylthiophen-3-amine.

Molecular Properties

Compound Name2-thiophen-2-ylthiophen-3-amine
PubChem CID12765253
Molecular FormulaC8H7NS2
Molecular Weight181.29 g/mol
Exact Mass181.00
IUPAC Name2-thiophen-2-ylthiophen-3-amine
SMILESNc1ccsc1-c1cccs1
InChIInChI=1S/C8H7NS2/c9-6-3-5-11-8(6)7-2-1-4-10-7/h1-5H,9H2
InChIKeyALVRMRYUXMLYKV-UHFFFAOYSA-N
XLogP3.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.29
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-ylthiophen-3-amine?
The IUPAC name of 2-thiophen-2-ylthiophen-3-amine (CID 12765253) is 2-thiophen-2-ylthiophen-3-amine.
What is the SMILES notation for 2-thiophen-2-ylthiophen-3-amine?
The canonical SMILES for 2-thiophen-2-ylthiophen-3-amine is Nc1ccsc1-c1cccs1.
What is the InChIKey of 2-thiophen-2-ylthiophen-3-amine?
The InChIKey is ALVRMRYUXMLYKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NS2/c9-6-3-5-11-8(6)7-2-1-4-10-7/h1-5H,9H2.
What are the key properties of 2-thiophen-2-ylthiophen-3-amine?
2-thiophen-2-ylthiophen-3-amine has a molecular weight of 181.29 g/mol, XLogP of 3.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-ylthiophen-3-amine is sourced from PubChem (CID 12765253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).