1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione

C8H10N4S — CID 10012864

IUPAC1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione
SMILESCNc1cc2n(C)ccn2c(=S)n1
InChIInChI=1S/C8H10N4S/c1-9-6-5-7-11(2)3-4-12(7)8(13)10-6/h3-5H,1-2H3,(H,9,10,13)
InChIKeyWWVPSFJZWSXXFT-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.44
Rot. Bonds1

About 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione

1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione (PubChem CID 10012864) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione.

Molecular Properties

Compound Name1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione
PubChem CID10012864
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC Name1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione
SMILESCNc1cc2n(C)ccn2c(=S)n1
InChIInChI=1S/C8H10N4S/c1-9-6-5-7-11(2)3-4-12(7)8(13)10-6/h3-5H,1-2H3,(H,9,10,13)
InChIKeyWWVPSFJZWSXXFT-UHFFFAOYSA-N
XLogP1.44
TPSA34.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione?
The IUPAC name of 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione (CID 10012864) is 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione.
What is the SMILES notation for 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione?
The canonical SMILES for 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione is CNc1cc2n(C)ccn2c(=S)n1.
What is the InChIKey of 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione?
The InChIKey is WWVPSFJZWSXXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c1-9-6-5-7-11(2)3-4-12(7)8(13)10-6/h3-5H,1-2H3,(H,9,10,13).
What are the key properties of 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione?
1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione has a molecular weight of 194.26 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7-(methylamino)imidazo[1,2-c]pyrimidine-5-thione is sourced from PubChem (CID 10012864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).