quinoline;thiophene

C17H15NS2 — CID 157162932

IUPACquinoline;thiophene
SMILESc1ccc2ncccc2c1.c1ccsc1.c1ccsc1
InChIInChI=1S/C9H7N.2C4H4S/c1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-4-5-3-1/h1-7H;2*1-4H
InChIKeyAMOQHGPERAKNOX-UHFFFAOYSA-N
MW297.45 g/mol
LogP5.73
Rot. Bonds

About quinoline;thiophene

quinoline;thiophene (PubChem CID 157162932) has the molecular formula C17H15NS2 and a molecular weight of 297.45 g/mol. Its IUPAC name is quinoline;thiophene.

Molecular Properties

Compound Namequinoline;thiophene
PubChem CID157162932
Molecular FormulaC17H15NS2
Molecular Weight297.45 g/mol
Exact Mass297.06
IUPAC Namequinoline;thiophene
SMILESc1ccc2ncccc2c1.c1ccsc1.c1ccsc1
InChIInChI=1S/C9H7N.2C4H4S/c1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-4-5-3-1/h1-7H;2*1-4H
InChIKeyAMOQHGPERAKNOX-UHFFFAOYSA-N
XLogP5.73
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.45
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of quinoline;thiophene?
The IUPAC name of quinoline;thiophene (CID 157162932) is quinoline;thiophene.
What is the SMILES notation for quinoline;thiophene?
The canonical SMILES for quinoline;thiophene is c1ccc2ncccc2c1.c1ccsc1.c1ccsc1.
What is the InChIKey of quinoline;thiophene?
The InChIKey is AMOQHGPERAKNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.2C4H4S/c1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-4-5-3-1/h1-7H;2*1-4H.
What are the key properties of quinoline;thiophene?
quinoline;thiophene has a molecular weight of 297.45 g/mol, XLogP of 5.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for quinoline;thiophene is sourced from PubChem (CID 157162932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).