4,7-dimethylthieno[3,2-d]pyrimidine;ethane

C10H14N2S — CID 143718992

IUPAC4,7-dimethylthieno[3,2-d]pyrimidine;ethane
SMILESCC.Cc1csc2c(C)ncnc12
InChIInChI=1S/C8H8N2S.C2H6/c1-5-3-11-8-6(2)9-4-10-7(5)8;1-2/h3-4H,1-2H3;1-2H3
InChIKeyMJEKPAUYHFKESN-UHFFFAOYSA-N
MW194.30 g/mol
LogP3.33
Rot. Bonds

About 4,7-dimethylthieno[3,2-d]pyrimidine;ethane

4,7-dimethylthieno[3,2-d]pyrimidine;ethane (PubChem CID 143718992) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 4,7-dimethylthieno[3,2-d]pyrimidine;ethane.

Molecular Properties

Compound Name4,7-dimethylthieno[3,2-d]pyrimidine;ethane
PubChem CID143718992
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Name4,7-dimethylthieno[3,2-d]pyrimidine;ethane
SMILESCC.Cc1csc2c(C)ncnc12
InChIInChI=1S/C8H8N2S.C2H6/c1-5-3-11-8-6(2)9-4-10-7(5)8;1-2/h3-4H,1-2H3;1-2H3
InChIKeyMJEKPAUYHFKESN-UHFFFAOYSA-N
XLogP3.33
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,7-dimethylthieno[3,2-d]pyrimidine;ethane?
The IUPAC name of 4,7-dimethylthieno[3,2-d]pyrimidine;ethane (CID 143718992) is 4,7-dimethylthieno[3,2-d]pyrimidine;ethane.
What is the SMILES notation for 4,7-dimethylthieno[3,2-d]pyrimidine;ethane?
The canonical SMILES for 4,7-dimethylthieno[3,2-d]pyrimidine;ethane is CC.Cc1csc2c(C)ncnc12.
What is the InChIKey of 4,7-dimethylthieno[3,2-d]pyrimidine;ethane?
The InChIKey is MJEKPAUYHFKESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2S.C2H6/c1-5-3-11-8-6(2)9-4-10-7(5)8;1-2/h3-4H,1-2H3;1-2H3.
What are the key properties of 4,7-dimethylthieno[3,2-d]pyrimidine;ethane?
4,7-dimethylthieno[3,2-d]pyrimidine;ethane has a molecular weight of 194.30 g/mol, XLogP of 3.33, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethylthieno[3,2-d]pyrimidine;ethane is sourced from PubChem (CID 143718992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).