2-methoxy-6-methylthieno[3,2-d]pyrimidine

C8H8N2OS — CID 131072143

IUPAC2-methoxy-6-methylthieno[3,2-d]pyrimidine
SMILESCOc1ncc2sc(C)cc2n1
InChIInChI=1S/C8H8N2OS/c1-5-3-6-7(12-5)4-9-8(10-6)11-2/h3-4H,1-2H3
InChIKeyVXAJFXRFKQKJCJ-UHFFFAOYSA-N
MW180.23 g/mol
LogP2.01
Rot. Bonds1

About 2-methoxy-6-methylthieno[3,2-d]pyrimidine

2-methoxy-6-methylthieno[3,2-d]pyrimidine (PubChem CID 131072143) has the molecular formula C8H8N2OS and a molecular weight of 180.23 g/mol. Its IUPAC name is 2-methoxy-6-methylthieno[3,2-d]pyrimidine.

Molecular Properties

Compound Name2-methoxy-6-methylthieno[3,2-d]pyrimidine
PubChem CID131072143
Molecular FormulaC8H8N2OS
Molecular Weight180.23 g/mol
Exact Mass180.04
IUPAC Name2-methoxy-6-methylthieno[3,2-d]pyrimidine
SMILESCOc1ncc2sc(C)cc2n1
InChIInChI=1S/C8H8N2OS/c1-5-3-6-7(12-5)4-9-8(10-6)11-2/h3-4H,1-2H3
InChIKeyVXAJFXRFKQKJCJ-UHFFFAOYSA-N
XLogP2.01
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-methylthieno[3,2-d]pyrimidine?
The IUPAC name of 2-methoxy-6-methylthieno[3,2-d]pyrimidine (CID 131072143) is 2-methoxy-6-methylthieno[3,2-d]pyrimidine.
What is the SMILES notation for 2-methoxy-6-methylthieno[3,2-d]pyrimidine?
The canonical SMILES for 2-methoxy-6-methylthieno[3,2-d]pyrimidine is COc1ncc2sc(C)cc2n1.
What is the InChIKey of 2-methoxy-6-methylthieno[3,2-d]pyrimidine?
The InChIKey is VXAJFXRFKQKJCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS/c1-5-3-6-7(12-5)4-9-8(10-6)11-2/h3-4H,1-2H3.
What are the key properties of 2-methoxy-6-methylthieno[3,2-d]pyrimidine?
2-methoxy-6-methylthieno[3,2-d]pyrimidine has a molecular weight of 180.23 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-methylthieno[3,2-d]pyrimidine is sourced from PubChem (CID 131072143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).