N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine

C60H70N10O5S — CID 159451184

About N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine

N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine (PubChem CID 159451184) has the molecular formula C60H70N10O5S and a molecular weight of 1043.35 g/mol. Its IUPAC name is N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine.

Molecular Properties

• Compound Name: N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine
• PubChem CID: 159451184
• Molecular Formula: C60H70N10O5S
• Molecular Weight: 1043.35 g/mol
• Exact Mass: 1042.53
• IUPAC Name: N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine
• SMILES: CC(=O)N1CCC(c2cc(C)cn3cccc23)CC1.CC(=O)N1CCN(c2cc(C)cn3cccc23)CC1.Cc1cc(N2CCN(S(C)(=O)=O)CC2)c2cccn2c1.O=C(Nc1cccn2cccc12)c1ccccc1
• InChI: InChI=1S/C16H20N2O.C15H19N3O.C15H12N2O.C14H19N3O2S/c1-12-10-15(16-4-3-7-18(16)11-12)14-5-8-17(9-6-14)13(2)19;1-12-10-15(14-4-3-5-18(14)11-12)17-8-6-16(7-9-17)13(2)19;18-15(12-6-2-1-3-7-12)16-13-8-4-10-17-11-5-9-14(13)17;1-12-10-14(13-4-3-5-16(13)11-12)15-6-8-17(9-7-15)20(2,18)19/h3-4,7,10-11,14H,5-6,8-9H2,1-2H3;3-5,10-11H,6-9H2,1-2H3;1-11H,(H,16,18);3-5,10-11H,6-9H2,1-2H3
• InChIKey: LTJZPHZWGXGLTP-UHFFFAOYSA-N
• XLogP: 9.41
• TPSA: 131.22 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 11
• Rotatable Bonds: 6
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1043.35
LogP ≤ 5	9.41
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine?

The IUPAC name of N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine (CID 159451184) is N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine.

What is the SMILES notation for N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine?

The canonical SMILES for N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine is CC(=O)N1CCC(c2cc(C)cn3cccc23)CC1.CC(=O)N1CCN(c2cc(C)cn3cccc23)CC1.Cc1cc(N2CCN(S(C)(=O)=O)CC2)c2cccn2c1.O=C(Nc1cccn2cccc12)c1ccccc1.

What is the InChIKey of N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine?

The InChIKey is LTJZPHZWGXGLTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O.C15H19N3O.C15H12N2O.C14H19N3O2S/c1-12-10-15(16-4-3-7-18(16)11-12)14-5-8-17(9-6-14)13(2)19;1-12-10-15(14-4-3-5-18(14)11-12)17-8-6-16(7-9-17)13(2)19;18-15(12-6-2-1-3-7-12)16-13-8-4-10-17-11-5-9-14(13)17;1-12-10-14(13-4-3-5-16(13)11-12)15-6-8-17(9-7-15)20(2,18)19/h3-4,7,10-11,14H,5-6,8-9H2,1-2H3;3-5,10-11H,6-9H2,1-2H3;1-11H,(H,16,18);3-5,10-11H,6-9H2,1-2H3.

What are the key properties of N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine?

N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine has a molecular weight of 1043.35 g/mol, XLogP of 9.41, 6 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-indolizin-8-ylbenzamide;1-[4-(6-methylindolizin-8-yl)piperazin-1-yl]ethanone;1-[4-(6-methylindolizin-8-yl)piperidin-1-yl]ethanone;6-methyl-8-(4-methylsulfonylpiperazin-1-yl)indolizine is sourced from PubChem (CID 159451184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).