5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine

C6H8N4S — CID 83816059

IUPAC5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine
SMILESNc1nc(N)c2c(n1)SCC2
InChIInChI=1S/C6H8N4S/c7-4-3-1-2-11-5(3)10-6(8)9-4/h1-2H2,(H4,7,8,9,10)
InChIKeyZWUVVCNEUZQTEV-UHFFFAOYSA-N
MW168.22 g/mol
LogP0.29
Rot. Bonds

About 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine

5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 83816059) has the molecular formula C6H8N4S and a molecular weight of 168.22 g/mol. Its IUPAC name is 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID83816059
Molecular FormulaC6H8N4S
Molecular Weight168.22 g/mol
Exact Mass168.05
IUPAC Name5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine
SMILESNc1nc(N)c2c(n1)SCC2
InChIInChI=1S/C6H8N4S/c7-4-3-1-2-11-5(3)10-6(8)9-4/h1-2H2,(H4,7,8,9,10)
InChIKeyZWUVVCNEUZQTEV-UHFFFAOYSA-N
XLogP0.29
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine (CID 83816059) is 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine is Nc1nc(N)c2c(n1)SCC2.
What is the InChIKey of 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is ZWUVVCNEUZQTEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4S/c7-4-3-1-2-11-5(3)10-6(8)9-4/h1-2H2,(H4,7,8,9,10).
What are the key properties of 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine?
5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 168.22 g/mol, XLogP of 0.29, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydrothieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 83816059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).