4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one

C9H11N3OS — CID 25152412

IUPAC4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one
SMILESCc1sc2c(c(N)nc(=O)n2C)c1C
InChIInChI=1S/C9H11N3OS/c1-4-5(2)14-8-6(4)7(10)11-9(13)12(8)3/h1-3H3,(H2,10,11,13)
InChIKeyWVJGVKJHZSVEJT-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.19
Rot. Bonds

About 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one

4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one (PubChem CID 25152412) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one
PubChem CID25152412
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC Name4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one
SMILESCc1sc2c(c(N)nc(=O)n2C)c1C
InChIInChI=1S/C9H11N3OS/c1-4-5(2)14-8-6(4)7(10)11-9(13)12(8)3/h1-3H3,(H2,10,11,13)
InChIKeyWVJGVKJHZSVEJT-UHFFFAOYSA-N
XLogP1.19
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one?
The IUPAC name of 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one (CID 25152412) is 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one.
What is the SMILES notation for 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one?
The canonical SMILES for 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one is Cc1sc2c(c(N)nc(=O)n2C)c1C.
What is the InChIKey of 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one?
The InChIKey is WVJGVKJHZSVEJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c1-4-5(2)14-8-6(4)7(10)11-9(13)12(8)3/h1-3H3,(H2,10,11,13).
What are the key properties of 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one?
4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one has a molecular weight of 209.27 g/mol, XLogP of 1.19, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1,5,6-trimethylthieno[2,3-d]pyrimidin-2-one is sourced from PubChem (CID 25152412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).