butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium

C123H254N10O10S10+10 — CID 162164090

About butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium

butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium (PubChem CID 162164090) has the molecular formula C123H254N10O10S10+10 and a molecular weight of 2354.11 g/mol. Its IUPAC name is butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium.

Molecular Properties

• Compound Name: butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium
• PubChem CID: 162164090
• Molecular Formula: C123H254N10O10S10+10
• Molecular Weight: 2354.11 g/mol
• Exact Mass: 2351.68
• IUPAC Name: butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium
• SMILES: C=C(C)C(=O)SCC[N+](C)(C)C.C=C(C)C(=O)SCC[N+](CC)(CC)CC.C=C(C)C(=O)SCC[N+](CC)(CCC)CCC.C=C(C)C(=O)SCC[N+](CC)(CCC)CCCC.C=CC(=O)SCC[N+](C)(C)C.C=CC(=O)SCC[N+](CC)(CC)CC.CC(C)(C)C(=O)SCC[N+](C)(C)C.CCCC[N+](CC)(CCC)CCSC(=O)C(C)(C)C.CCC[N+](CC)(CCC)CCSC(=O)C(C)(C)C.CC[N+](CC)(CC)CCSC(=O)C(C)(C)C
• InChI: InChI=1S/C16H34NOS.C15H32NOS.C15H30NOS.C14H28NOS.C13H28NOS.C12H24NOS.C11H22NOS.C10H22NOS.C9H18NOS.C8H16NOS/c1-7-10-12-17(9-3,11-8-2)13-14-19-15(18)16(4,5)6;1-7-10-16(9-3,11-8-2)12-13-18-14(17)15(4,5)6;1-6-9-11-16(8-3,10-7-2)12-13-18-15(17)14(4)5;1-6-9-15(8-3,10-7-2)11-12-17-14(16)13(4)5;1-7-14(8-2,9-3)10-11-16-12(15)13(4,5)6;1-6-13(7-2,8-3)9-10-15-12(14)11(4)5;1-5-11(13)14-10-9-12(6-2,7-3)8-4;1-10(2,3)9(12)13-8-7-11(4,5)6;1-8(2)9(11)12-7-6-10(3,4)5;1-5-8(10)11-7-6-9(2,3)4/h7-14H2,1-6H3;7-13H2,1-6H3;4,6-13H2,1-3,5H3;4,6-12H2,1-3,5H3;7-11H2,1-6H3;4,6-10H2,1-3,5H3;5H,1,6-10H2,2-4H3;7-8H2,1-6H3;1,6-7H2,2-5H3;5H,1,6-7H2,2-4H3/q10*+1
• InChIKey: ZMWVAWRHCYDUHL-UHFFFAOYSA-N
• XLogP: 28.48
• TPSA: 170.70 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 67
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2354.11
LogP ≤ 5	28.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium?

The IUPAC name of butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium (CID 162164090) is butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium.

What is the SMILES notation for butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium?

The canonical SMILES for butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium is C=C(C)C(=O)SCC[N+](C)(C)C.C=C(C)C(=O)SCC[N+](CC)(CC)CC.C=C(C)C(=O)SCC[N+](CC)(CCC)CCC.C=C(C)C(=O)SCC[N+](CC)(CCC)CCCC.C=CC(=O)SCC[N+](C)(C)C.C=CC(=O)SCC[N+](CC)(CC)CC.CC(C)(C)C(=O)SCC[N+](C)(C)C.CCCC[N+](CC)(CCC)CCSC(=O)C(C)(C)C.CCC[N+](CC)(CCC)CCSC(=O)C(C)(C)C.CC[N+](CC)(CC)CCSC(=O)C(C)(C)C.

What is the InChIKey of butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium?

The InChIKey is ZMWVAWRHCYDUHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34NOS.C15H32NOS.C15H30NOS.C14H28NOS.C13H28NOS.C12H24NOS.C11H22NOS.C10H22NOS.C9H18NOS.C8H16NOS/c1-7-10-12-17(9-3,11-8-2)13-14-19-15(18)16(4,5)6;1-7-10-16(9-3,11-8-2)12-13-18-14(17)15(4,5)6;1-6-9-11-16(8-3,10-7-2)12-13-18-15(17)14(4)5;1-6-9-15(8-3,10-7-2)11-12-17-14(16)13(4)5;1-7-14(8-2,9-3)10-11-16-12(15)13(4,5)6;1-6-13(7-2,8-3)9-10-15-12(14)11(4)5;1-5-11(13)14-10-9-12(6-2,7-3)8-4;1-10(2,3)9(12)13-8-7-11(4,5)6;1-8(2)9(11)12-7-6-10(3,4)5;1-5-8(10)11-7-6-9(2,3)4/h7-14H2,1-6H3;7-13H2,1-6H3;4,6-13H2,1-3,5H3;4,6-12H2,1-3,5H3;7-11H2,1-6H3;4,6-10H2,1-3,5H3;5H,1,6-10H2,2-4H3;7-8H2,1-6H3;1,6-7H2,2-5H3;5H,1,6-7H2,2-4H3/q10*+1.

What are the key properties of butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium?

butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium has a molecular weight of 2354.11 g/mol, XLogP of 28.48, 67 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for butyl-[2-(2,2-dimethylpropanoylsulfanyl)ethyl]-ethyl-propylazanium;butyl-ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-propylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-ethyl-dipropylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-triethylazanium;2-(2,2-dimethylpropanoylsulfanyl)ethyl-trimethylazanium;ethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]-dipropylazanium;triethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;triethyl(2-prop-2-enoylsulfanylethyl)azanium;trimethyl-[2-(2-methylprop-2-enoylsulfanyl)ethyl]azanium;trimethyl(2-prop-2-enoylsulfanylethyl)azanium is sourced from PubChem (CID 162164090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).