4-quinolin-8-yloxythieno[2,3-d]pyrimidine

C15H9N3OS — CID 2435279

IUPAC4-quinolin-8-yloxythieno[2,3-d]pyrimidine
SMILESc1cnc2c(Oc3ncnc4sccc34)cccc2c1
InChIInChI=1S/C15H9N3OS/c1-3-10-4-2-7-16-13(10)12(5-1)19-14-11-6-8-20-15(11)18-9-17-14/h1-9H
InChIKeyILPQMLGSVMQSMI-UHFFFAOYSA-N
MW279.32 g/mol
LogP4.03
Rot. Bonds2

About 4-quinolin-8-yloxythieno[2,3-d]pyrimidine

4-quinolin-8-yloxythieno[2,3-d]pyrimidine (PubChem CID 2435279) has the molecular formula C15H9N3OS and a molecular weight of 279.32 g/mol. Its IUPAC name is 4-quinolin-8-yloxythieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-quinolin-8-yloxythieno[2,3-d]pyrimidine
PubChem CID2435279
Molecular FormulaC15H9N3OS
Molecular Weight279.32 g/mol
Exact Mass279.05
IUPAC Name4-quinolin-8-yloxythieno[2,3-d]pyrimidine
SMILESc1cnc2c(Oc3ncnc4sccc34)cccc2c1
InChIInChI=1S/C15H9N3OS/c1-3-10-4-2-7-16-13(10)12(5-1)19-14-11-6-8-20-15(11)18-9-17-14/h1-9H
InChIKeyILPQMLGSVMQSMI-UHFFFAOYSA-N
XLogP4.03
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-quinolin-8-yloxythieno[2,3-d]pyrimidine?
The IUPAC name of 4-quinolin-8-yloxythieno[2,3-d]pyrimidine (CID 2435279) is 4-quinolin-8-yloxythieno[2,3-d]pyrimidine.
What is the SMILES notation for 4-quinolin-8-yloxythieno[2,3-d]pyrimidine?
The canonical SMILES for 4-quinolin-8-yloxythieno[2,3-d]pyrimidine is c1cnc2c(Oc3ncnc4sccc34)cccc2c1.
What is the InChIKey of 4-quinolin-8-yloxythieno[2,3-d]pyrimidine?
The InChIKey is ILPQMLGSVMQSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N3OS/c1-3-10-4-2-7-16-13(10)12(5-1)19-14-11-6-8-20-15(11)18-9-17-14/h1-9H.
What are the key properties of 4-quinolin-8-yloxythieno[2,3-d]pyrimidine?
4-quinolin-8-yloxythieno[2,3-d]pyrimidine has a molecular weight of 279.32 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-quinolin-8-yloxythieno[2,3-d]pyrimidine is sourced from PubChem (CID 2435279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).