N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C11H10N4O2S2 — CID 7266743

IUPACN-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESCc1cn2c(=O)c(C(=O)NC3=NCCS3)cnc2s1
InChIInChI=1S/C11H10N4O2S2/c1-6-5-15-9(17)7(4-13-11(15)19-6)8(16)14-10-12-2-3-18-10/h4-5H,2-3H2,1H3,(H,12,14,16)
InChIKeyUREOCMSJXDWXOD-UHFFFAOYSA-N
MW294.36 g/mol
LogP0.90
Rot. Bonds1

About N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 7266743) has the molecular formula C11H10N4O2S2 and a molecular weight of 294.36 g/mol. Its IUPAC name is N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID7266743
Molecular FormulaC11H10N4O2S2
Molecular Weight294.36 g/mol
Exact Mass294.02
IUPAC NameN-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESCc1cn2c(=O)c(C(=O)NC3=NCCS3)cnc2s1
InChIInChI=1S/C11H10N4O2S2/c1-6-5-15-9(17)7(4-13-11(15)19-6)8(16)14-10-12-2-3-18-10/h4-5H,2-3H2,1H3,(H,12,14,16)
InChIKeyUREOCMSJXDWXOD-UHFFFAOYSA-N
XLogP0.90
TPSA75.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 7266743) is N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is Cc1cn2c(=O)c(C(=O)NC3=NCCS3)cnc2s1.
What is the InChIKey of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is UREOCMSJXDWXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O2S2/c1-6-5-15-9(17)7(4-13-11(15)19-6)8(16)14-10-12-2-3-18-10/h4-5H,2-3H2,1H3,(H,12,14,16).
What are the key properties of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 294.36 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 7266743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).