2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))

C64H110N8O16S6W2 — CID 159937006

About 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))

2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)) (PubChem CID 159937006) has the molecular formula C64H110N8O16S6W2 and a molecular weight of 1807.71 g/mol. Its IUPAC name is 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)).

Molecular Properties

• Compound Name: 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))
• PubChem CID: 159937006
• Molecular Formula: C64H110N8O16S6W2
• Molecular Weight: 1807.71 g/mol
• Exact Mass: 1806.54
• IUPAC Name: 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))
• SMILES: CCCCSC1CCC1SCCCC(=O)CN(CCN(CC(C)=O)CC(=O)O)CC(=O)O.CCCCSC1CCC1SCCCC(=O)CN(C[C-]=O)CCN(C[C-]=O)CC(C)=O.NCCSC1CCC1SCCN.O=C1CN(CCN2CC(=O)OC(=O)C2)CC(=O)O1.[CH3-].[CH3-].[W+2].[W+2]
• InChI: InChI=1S/C22H38N2O6S2.C22H36N2O4S2.C10H12N2O6.C8H18N2S2.2CH3.2W/c1-3-4-11-31-19-7-8-20(19)32-12-5-6-18(26)14-24(16-22(29)30)10-9-23(13-17(2)25)15-21(27)28;1-3-4-15-29-21-7-8-22(21)30-16-5-6-20(28)18-24(12-14-26)10-9-23(11-13-25)17-19(2)27;13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12;9-3-5-11-7-1-2-8(7)12-6-4-10;;;;/h19-20H,3-16H2,1-2H3,(H,27,28)(H,29,30);21-22H,3-12,15-18H2,1-2H3;1-6H2;7-8H,1-6,9-10H2;2*1H3;;/q;-2;;;2*-1;2*+2
• InChIKey: XRJQDUZYDZSXRF-UHFFFAOYSA-N
• XLogP: 4.59
• TPSA: 335.24 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 28
• Rotatable Bonds: 49
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1807.71
LogP ≤ 5	4.59
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))?

The IUPAC name of 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)) (CID 159937006) is 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)).

What is the SMILES notation for 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))?

The canonical SMILES for 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)) is CCCCSC1CCC1SCCCC(=O)CN(CCN(CC(C)=O)CC(=O)O)CC(=O)O.CCCCSC1CCC1SCCCC(=O)CN(C[C-]=O)CCN(C[C-]=O)CC(C)=O.NCCSC1CCC1SCCN.O=C1CN(CCN2CC(=O)OC(=O)C2)CC(=O)O1.[CH3-].[CH3-].[W+2].[W+2].

What is the InChIKey of 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))?

The InChIKey is XRJQDUZYDZSXRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38N2O6S2.C22H36N2O4S2.C10H12N2O6.C8H18N2S2.2CH3.2W/c1-3-4-11-31-19-7-8-20(19)32-12-5-6-18(26)14-24(16-22(29)30)10-9-23(13-17(2)25)15-21(27)28;1-3-4-15-29-21-7-8-22(21)30-16-5-6-20(28)18-24(12-14-26)10-9-23(11-13-25)17-19(2)27;13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12;9-3-5-11-7-1-2-8(7)12-6-4-10;;;;/h19-20H,3-16H2,1-2H3,(H,27,28)(H,29,30);21-22H,3-12,15-18H2,1-2H3;1-6H2;7-8H,1-6,9-10H2;2*1H3;;/q;-2;;;2*-1;2*+2.

What are the key properties of 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+))?

2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)) has a molecular weight of 1807.71 g/mol, XLogP of 4.59, 49 rotatable bonds, 4 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-(2-aminoethylsulfanyl)cyclobutyl]sulfanylethanamine;5-(2-butylsulfanylcyclobutyl)sulfanyl-1-[2-oxoethyl-[2-[2-oxoethyl(2-oxopropyl)amino]ethyl]amino]pentan-2-one;2-[2-[[5-(2-butylsulfanylcyclobutyl)sulfanyl-2-oxopentyl]-(carboxymethyl)amino]ethyl-(2-oxopropyl)amino]acetic acid;carbanide;4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione;bis(tungsten(2+)) is sourced from PubChem (CID 159937006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).