N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide

C19H18N4O2S — CID 56918583

About N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide

N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 56918583) has the molecular formula C19H18N4O2S and a molecular weight of 366.45 g/mol. Its IUPAC name is N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

• Compound Name: N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
• PubChem CID: 56918583
• Molecular Formula: C19H18N4O2S
• Molecular Weight: 366.45 g/mol
• Exact Mass: 366.12
• IUPAC Name: N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
• SMILES: O=C(NC1CC(=O)N(C2Cc3ccccc3C2)C1)c1cn2ccsc2n1
• InChI: InChI=1S/C19H18N4O2S/c24-17-9-14(20-18(25)16-11-22-5-6-26-19(22)21-16)10-23(17)15-7-12-3-1-2-4-13(12)8-15/h1-6,11,14-15H,7-10H2,(H,20,25)
• InChIKey: AQFJQTDZMOGKLT-UHFFFAOYSA-N
• XLogP: 1.89
• TPSA: 66.71 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	366.45
LogP ≤ 5	1.89
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?

The IUPAC name of N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 56918583) is N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide.

What is the SMILES notation for N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?

The canonical SMILES for N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide is O=C(NC1CC(=O)N(C2Cc3ccccc3C2)C1)c1cn2ccsc2n1.

What is the InChIKey of N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?

The InChIKey is AQFJQTDZMOGKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2S/c24-17-9-14(20-18(25)16-11-22-5-6-26-19(22)21-16)10-23(17)15-7-12-3-1-2-4-13(12)8-15/h1-6,11,14-15H,7-10H2,(H,20,25).

What are the key properties of N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?

N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 366.45 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 56918583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).