N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C16H22N4O2S — CID 51179662

IUPACN-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESCC(C)(CNC(=O)c1cnc2sccn2c1=O)N1CCCCC1
InChIInChI=1S/C16H22N4O2S/c1-16(2,19-6-4-3-5-7-19)11-18-13(21)12-10-17-15-20(14(12)22)8-9-23-15/h8-10H,3-7,11H2,1-2H3,(H,18,21)
InChIKeyLETAOJZBHUIBTF-UHFFFAOYSA-N
MW334.45 g/mol
LogP1.75
Rot. Bonds4

About N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 51179662) has the molecular formula C16H22N4O2S and a molecular weight of 334.45 g/mol. Its IUPAC name is N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID51179662
Molecular FormulaC16H22N4O2S
Molecular Weight334.45 g/mol
Exact Mass334.15
IUPAC NameN-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESCC(C)(CNC(=O)c1cnc2sccn2c1=O)N1CCCCC1
InChIInChI=1S/C16H22N4O2S/c1-16(2,19-6-4-3-5-7-19)11-18-13(21)12-10-17-15-20(14(12)22)8-9-23-15/h8-10H,3-7,11H2,1-2H3,(H,18,21)
InChIKeyLETAOJZBHUIBTF-UHFFFAOYSA-N
XLogP1.75
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.45
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 51179662) is N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is CC(C)(CNC(=O)c1cnc2sccn2c1=O)N1CCCCC1.
What is the InChIKey of N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is LETAOJZBHUIBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2S/c1-16(2,19-6-4-3-5-7-19)11-18-13(21)12-10-17-15-20(14(12)22)8-9-23-15/h8-10H,3-7,11H2,1-2H3,(H,18,21).
What are the key properties of N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 334.45 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-piperidin-1-ylpropyl)-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 51179662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).