5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide

C8H8N4O2S — CID 13295941

IUPAC5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide
SMILESCOc1ncnc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C8H8N4O2S/c1-14-7-3-4(9)5(6(10)13)15-8(3)12-2-11-7/h2H,9H2,1H3,(H2,10,13)
InChIKeyDOPZJEWVKMEYQG-UHFFFAOYSA-N
MW224.25 g/mol
LogP0.38
Rot. Bonds2

About 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide

5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide (PubChem CID 13295941) has the molecular formula C8H8N4O2S and a molecular weight of 224.25 g/mol. Its IUPAC name is 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide
PubChem CID13295941
Molecular FormulaC8H8N4O2S
Molecular Weight224.25 g/mol
Exact Mass224.04
IUPAC Name5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide
SMILESCOc1ncnc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C8H8N4O2S/c1-14-7-3-4(9)5(6(10)13)15-8(3)12-2-11-7/h2H,9H2,1H3,(H2,10,13)
InChIKeyDOPZJEWVKMEYQG-UHFFFAOYSA-N
XLogP0.38
TPSA104.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.25
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide (CID 13295941) is 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide is COc1ncnc2sc(C(N)=O)c(N)c12.
What is the InChIKey of 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is DOPZJEWVKMEYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2S/c1-14-7-3-4(9)5(6(10)13)15-8(3)12-2-11-7/h2H,9H2,1H3,(H2,10,13).
What are the key properties of 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide?
5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 224.25 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 13295941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).