N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide

C11H11N3O2S — CID 16933418

IUPACN-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide
SMILESCc1nc2sccn2c(=O)c1NC(=O)C1CC1
InChIInChI=1S/C11H11N3O2S/c1-6-8(13-9(15)7-2-3-7)10(16)14-4-5-17-11(14)12-6/h4-5,7H,2-3H2,1H3,(H,13,15)
InChIKeyONKHFJBMUSCPTL-UHFFFAOYSA-N
MW249.29 g/mol
LogP1.41
Rot. Bonds2

About N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide

N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide (PubChem CID 16933418) has the molecular formula C11H11N3O2S and a molecular weight of 249.29 g/mol. Its IUPAC name is N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide
PubChem CID16933418
Molecular FormulaC11H11N3O2S
Molecular Weight249.29 g/mol
Exact Mass249.06
IUPAC NameN-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide
SMILESCc1nc2sccn2c(=O)c1NC(=O)C1CC1
InChIInChI=1S/C11H11N3O2S/c1-6-8(13-9(15)7-2-3-7)10(16)14-4-5-17-11(14)12-6/h4-5,7H,2-3H2,1H3,(H,13,15)
InChIKeyONKHFJBMUSCPTL-UHFFFAOYSA-N
XLogP1.41
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.29
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide?
The IUPAC name of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide (CID 16933418) is N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide is Cc1nc2sccn2c(=O)c1NC(=O)C1CC1.
What is the InChIKey of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide?
The InChIKey is ONKHFJBMUSCPTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S/c1-6-8(13-9(15)7-2-3-7)10(16)14-4-5-17-11(14)12-6/h4-5,7H,2-3H2,1H3,(H,13,15).
What are the key properties of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide?
N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide has a molecular weight of 249.29 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopropanecarboxamide is sourced from PubChem (CID 16933418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).