6-thiophen-3-ylquinolin-2-amine

C13H10N2S — CID 53346492

IUPAC6-thiophen-3-ylquinolin-2-amine
SMILESNc1ccc2cc(-c3ccsc3)ccc2n1
InChIInChI=1S/C13H10N2S/c14-13-4-2-10-7-9(1-3-12(10)15-13)11-5-6-16-8-11/h1-8H,(H2,14,15)
InChIKeySKHMHSCEONTQTF-UHFFFAOYSA-N
MW226.30 g/mol
LogP3.55
Rot. Bonds1

About 6-thiophen-3-ylquinolin-2-amine

6-thiophen-3-ylquinolin-2-amine (PubChem CID 53346492) has the molecular formula C13H10N2S and a molecular weight of 226.30 g/mol. Its IUPAC name is 6-thiophen-3-ylquinolin-2-amine.

Molecular Properties

Compound Name6-thiophen-3-ylquinolin-2-amine
PubChem CID53346492
Molecular FormulaC13H10N2S
Molecular Weight226.30 g/mol
Exact Mass226.06
IUPAC Name6-thiophen-3-ylquinolin-2-amine
SMILESNc1ccc2cc(-c3ccsc3)ccc2n1
InChIInChI=1S/C13H10N2S/c14-13-4-2-10-7-9(1-3-12(10)15-13)11-5-6-16-8-11/h1-8H,(H2,14,15)
InChIKeySKHMHSCEONTQTF-UHFFFAOYSA-N
XLogP3.55
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-thiophen-3-ylquinolin-2-amine?
The IUPAC name of 6-thiophen-3-ylquinolin-2-amine (CID 53346492) is 6-thiophen-3-ylquinolin-2-amine.
What is the SMILES notation for 6-thiophen-3-ylquinolin-2-amine?
The canonical SMILES for 6-thiophen-3-ylquinolin-2-amine is Nc1ccc2cc(-c3ccsc3)ccc2n1.
What is the InChIKey of 6-thiophen-3-ylquinolin-2-amine?
The InChIKey is SKHMHSCEONTQTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2S/c14-13-4-2-10-7-9(1-3-12(10)15-13)11-5-6-16-8-11/h1-8H,(H2,14,15).
What are the key properties of 6-thiophen-3-ylquinolin-2-amine?
6-thiophen-3-ylquinolin-2-amine has a molecular weight of 226.30 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-thiophen-3-ylquinolin-2-amine is sourced from PubChem (CID 53346492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).