N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide

C19H22N4O2S — CID 56705033

IUPACN-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCCN(C(=O)c1csc2nc(-c3cc(C)ccc3C)cn12)C(C)C(N)=O
InChIInChI=1S/C19H22N4O2S/c1-5-22(13(4)17(20)24)18(25)16-10-26-19-21-15(9-23(16)19)14-8-11(2)6-7-12(14)3/h6-10,13H,5H2,1-4H3,(H2,20,24)
InChIKeyCOEUKSBPLUTSHG-UHFFFAOYSA-N
MW370.48 g/mol
LogP3.02
Rot. Bonds5

About N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide

N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide (PubChem CID 56705033) has the molecular formula C19H22N4O2S and a molecular weight of 370.48 g/mol. Its IUPAC name is N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide
PubChem CID56705033
Molecular FormulaC19H22N4O2S
Molecular Weight370.48 g/mol
Exact Mass370.15
IUPAC NameN-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCCN(C(=O)c1csc2nc(-c3cc(C)ccc3C)cn12)C(C)C(N)=O
InChIInChI=1S/C19H22N4O2S/c1-5-22(13(4)17(20)24)18(25)16-10-26-19-21-15(9-23(16)19)14-8-11(2)6-7-12(14)3/h6-10,13H,5H2,1-4H3,(H2,20,24)
InChIKeyCOEUKSBPLUTSHG-UHFFFAOYSA-N
XLogP3.02
TPSA80.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.48
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-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-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The IUPAC name of N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide (CID 56705033) is N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide.
What is the SMILES notation for N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The canonical SMILES for N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide is CCN(C(=O)c1csc2nc(-c3cc(C)ccc3C)cn12)C(C)C(N)=O.
What is the InChIKey of N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The InChIKey is COEUKSBPLUTSHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2S/c1-5-22(13(4)17(20)24)18(25)16-10-26-19-21-15(9-23(16)19)14-8-11(2)6-7-12(14)3/h6-10,13H,5H2,1-4H3,(H2,20,24).
What are the key properties of N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide has a molecular weight of 370.48 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-1-oxopropan-2-yl)-6-(2,5-dimethylphenyl)-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide is sourced from PubChem (CID 56705033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).