2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine

C10H9NS2 — CID 901483

IUPAC2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine
SMILESNc1ccsc1/C=C/c1cccs1
InChIInChI=1S/C10H9NS2/c11-9-5-7-13-10(9)4-3-8-2-1-6-12-8/h1-7H,11H2/b4-3+
InChIKeyVRVDDPKGGKFFKL-ONEGZZNKSA-N
MW207.32 g/mol
LogP3.56
Rot. Bonds2

About 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine

2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine (PubChem CID 901483) has the molecular formula C10H9NS2 and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine.

Molecular Properties

Compound Name2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine
PubChem CID901483
Molecular FormulaC10H9NS2
Molecular Weight207.32 g/mol
Exact Mass207.02
IUPAC Name2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine
SMILESNc1ccsc1/C=C/c1cccs1
InChIInChI=1S/C10H9NS2/c11-9-5-7-13-10(9)4-3-8-2-1-6-12-8/h1-7H,11H2/b4-3+
InChIKeyVRVDDPKGGKFFKL-ONEGZZNKSA-N
XLogP3.56
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiophene_amino_E(2)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine?
The IUPAC name of 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine (CID 901483) is 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine.
What is the SMILES notation for 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine?
The canonical SMILES for 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine is Nc1ccsc1/C=C/c1cccs1.
What is the InChIKey of 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine?
The InChIKey is VRVDDPKGGKFFKL-ONEGZZNKSA-N. The full InChI is InChI=1S/C10H9NS2/c11-9-5-7-13-10(9)4-3-8-2-1-6-12-8/h1-7H,11H2/b4-3+.
What are the key properties of 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine?
2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine has a molecular weight of 207.32 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-thiophen-2-ylethenyl]thiophen-3-amine is sourced from PubChem (CID 901483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).