8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine

C8H9N3S — CID 123266050

IUPAC8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine
SMILESCSc1ncc(C)c2nccn12
InChIInChI=1S/C8H9N3S/c1-6-5-10-8(12-2)11-4-3-9-7(6)11/h3-5H,1-2H3
InChIKeyPZHGJFMSVCSCER-UHFFFAOYSA-N
MW179.25 g/mol
LogP1.76
Rot. Bonds1

About 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine

8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine (PubChem CID 123266050) has the molecular formula C8H9N3S and a molecular weight of 179.25 g/mol. Its IUPAC name is 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine
PubChem CID123266050
Molecular FormulaC8H9N3S
Molecular Weight179.25 g/mol
Exact Mass179.05
IUPAC Name8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine
SMILESCSc1ncc(C)c2nccn12
InChIInChI=1S/C8H9N3S/c1-6-5-10-8(12-2)11-4-3-9-7(6)11/h3-5H,1-2H3
InChIKeyPZHGJFMSVCSCER-UHFFFAOYSA-N
XLogP1.76
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.25
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
The IUPAC name of 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine (CID 123266050) is 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine.
What is the SMILES notation for 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
The canonical SMILES for 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine is CSc1ncc(C)c2nccn12.
What is the InChIKey of 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
The InChIKey is PZHGJFMSVCSCER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3S/c1-6-5-10-8(12-2)11-4-3-9-7(6)11/h3-5H,1-2H3.
What are the key properties of 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine has a molecular weight of 179.25 g/mol, XLogP of 1.76, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine is sourced from PubChem (CID 123266050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).