heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)

C110H155F14N7O49Rf7S7-14 — CID 161469447

IUPACheptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)
SMILESCC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)N1CCCCC1=O.O=C1CCCCN1C(=O)C12CC3CC(CC(C3)C1)C2.O=C1CCCCN1C(=O)C1CC1.O=C1CCCCN1C(=O)C1CCC1.O=C1CCCCN1C(=O)C1CCCC1.O=C1CCCCN1C(=O)C1CCCCC1.O=C1CCCCN1C(=O)C1CCCCCCC1.[Rf].[Rf].[Rf].[Rf].[Rf].[Rf].[Rf]
InChIInChI=1S/C16H23NO2.C14H23NO2.C12H19NO2.C11H17NO2.C10H15NO2.C10H17NO2.C9H13NO2.7C4H5F2O5S.7Rf/c18-14-3-1-2-4-17(14)15(19)16-8-11-5-12(9-16)7-13(6-11)10-16;16-13-10-6-7-11-15(13)14(17)12-8-4-2-1-3-5-9-12;14-11-8-4-5-9-13(11)12(15)10-6-2-1-3-7-10;13-10-7-3-4-8-12(10)11(14)9-5-1-2-6-9;12-9-6-1-2-7-11(9)10(13)8-4-3-5-8;1-10(2,3)9(13)11-7-5-4-6-8(11)12;11-8-3-1-2-6-10(8)9(12)7-4-5-7;7*1-3(7)11-2-4(5,6)12(8,9)10;;;;;;;/h11-13H,1-10H2;12H,1-11H2;10H,1-9H2;9H,1-8H2;8H,1-7H2;4-7H2,1-3H3;7H,1-6H2;7*2H,1H3,(H,8,9,10);;;;;;;/q;;;;;;;7*-1;;;;;;;/p-7
InChIKeyJVYKPKZPANXWHL-UHFFFAOYSA-G
MW4718.89 g/mol
LogP12.23
Rot. Bonds27

About heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)

heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium) (PubChem CID 161469447) has the molecular formula C110H155F14N7O49Rf7S7-14 and a molecular weight of 4718.89 g/mol. Its IUPAC name is heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium).

Molecular Properties

Compound Nameheptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)
PubChem CID161469447
Molecular FormulaC110H155F14N7O49Rf7S7-14
Molecular Weight4718.89 g/mol
Exact Mass4717.63
IUPAC Nameheptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)
SMILESCC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)N1CCCCC1=O.O=C1CCCCN1C(=O)C12CC3CC(CC(C3)C1)C2.O=C1CCCCN1C(=O)C1CC1.O=C1CCCCN1C(=O)C1CCC1.O=C1CCCCN1C(=O)C1CCCC1.O=C1CCCCN1C(=O)C1CCCCC1.O=C1CCCCN1C(=O)C1CCCCCCC1.[Rf].[Rf].[Rf].[Rf].[Rf].[Rf].[Rf]
InChIInChI=1S/C16H23NO2.C14H23NO2.C12H19NO2.C11H17NO2.C10H15NO2.C10H17NO2.C9H13NO2.7C4H5F2O5S.7Rf/c18-14-3-1-2-4-17(14)15(19)16-8-11-5-12(9-16)7-13(6-11)10-16;16-13-10-6-7-11-15(13)14(17)12-8-4-2-1-3-5-9-12;14-11-8-4-5-9-13(11)12(15)10-6-2-1-3-7-10;13-10-7-3-4-8-12(10)11(14)9-5-1-2-6-9;12-9-6-1-2-7-11(9)10(13)8-4-3-5-8;1-10(2,3)9(13)11-7-5-4-6-8(11)12;11-8-3-1-2-6-10(8)9(12)7-4-5-7;7*1-3(7)11-2-4(5,6)12(8,9)10;;;;;;;/h11-13H,1-10H2;12H,1-11H2;10H,1-9H2;9H,1-8H2;8H,1-7H2;4-7H2,1-3H3;7H,1-6H2;7*2H,1H3,(H,8,9,10);;;;;;;/q;;;;;;;7*-1;;;;;;;/p-7
InChIKeyJVYKPKZPANXWHL-UHFFFAOYSA-G
XLogP12.23
TPSA846.16 Ų
H-Bond Donors
H-Bond Acceptors49
Rotatable Bonds27
Heavy Atoms194
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004718.89
LogP ≤ 512.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1049

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium) with MolForge

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Related Compounds

1-(adamantane-1-carbonyl)piperidin-2-one
CID 153488108
tris(2-acetyloxy-3,3,3-trifluoro-2-methylpropane-1-sulfonate);1-acetylpyrrolidin-2-one;1-(adamantane-2-carbonyl)pyrrolidin-2-one;1-benzoylpyrrolidin-2-one;1-(cyclohexanecarbonyl)pyrrolidin-2-one;tetrakis(1,1-difluoro-2-[2-(2-methoxy-2-oxoethoxy)acetyl]oxyethanesulfonate);1-(2,2-dimethylpropanoyl)pyrrolidin-2-one;1-(naphthalene-1-carbonyl)pyrrolidin-2-one;1-(naphthalene-2-carbonyl)pyrrolidin-2-one;tetrakis(rutherfordium)
CID 158045836
2-[4-tert-butyl-5-oxo-2-(4-oxoadamantane-1-carbonyl)oxy-8-thia-4-azatricyclo[4.2.1.03,7]nonane-9-carbonyl]oxy-1,1-difluoroethanesulfonate;rutherfordium
CID 153488051
2-[2-acetyloxy-4-(2,2-dimethylpropanoyl)-5-oxo-4-azatricyclo[4.2.1.03,7]nonane-9-carbonyl]oxy-1,1-difluoroethanesulfonate;rutherfordium
CID 153488095
2-[4-tert-butyl-2-(cyclobutanecarbonyloxy)-5-oxo-8-oxa-4-azatricyclo[4.2.1.03,7]nonane-9-carbonyl]oxy-1,1-difluoroethanesulfonate;rutherfordium
CID 153488023
1-[2-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-oxoethyl]azocan-2-one
CID 55758315
1-adamantyl-(2-methylpiperidin-1-yl)methanone
CID 2896597
2-cycloheptylpropan-2-yl 2-oxopyrrolidine-1-carboxylate
CID 123751962
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 3-(adamantane-1-carbonylamino)propanoate
CID 8528272
1-acetylazonan-2-one
CID 19035113
(2-oxopyrrolidin-1-yl) adamantane-1-carboxylate
CID 123232829
dodecakis(2-acetyloxy-1,1-difluoroethanesulfonate);2-(1-adamantyl)-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-(2-adamantyl)-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-butan-2-yl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-tert-butyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-cyclobutyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-cyclohexyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-cyclooctyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-cyclopentyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-cyclopropyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-ethyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-methyl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;2-propan-2-yl-3a,4,5,6,7,7a-hexahydro-3H-4,7-epoxyisoindol-1-one;dodecakis(rutherfordium)
CID 159667189

Frequently Asked Questions

What is the IUPAC name of heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)?
The IUPAC name of heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium) (CID 161469447) is heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium).
What is the SMILES notation for heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)?
The canonical SMILES for heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium) is CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(=O)O[CH-]C(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)N1CCCCC1=O.O=C1CCCCN1C(=O)C12CC3CC(CC(C3)C1)C2.O=C1CCCCN1C(=O)C1CC1.O=C1CCCCN1C(=O)C1CCC1.O=C1CCCCN1C(=O)C1CCCC1.O=C1CCCCN1C(=O)C1CCCCC1.O=C1CCCCN1C(=O)C1CCCCCCC1.[Rf].[Rf].[Rf].[Rf].[Rf].[Rf].[Rf].
What is the InChIKey of heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)?
The InChIKey is JVYKPKZPANXWHL-UHFFFAOYSA-G. The full InChI is InChI=1S/C16H23NO2.C14H23NO2.C12H19NO2.C11H17NO2.C10H15NO2.C10H17NO2.C9H13NO2.7C4H5F2O5S.7Rf/c18-14-3-1-2-4-17(14)15(19)16-8-11-5-12(9-16)7-13(6-11)10-16;16-13-10-6-7-11-15(13)14(17)12-8-4-2-1-3-5-9-12;14-11-8-4-5-9-13(11)12(15)10-6-2-1-3-7-10;13-10-7-3-4-8-12(10)11(14)9-5-1-2-6-9;12-9-6-1-2-7-11(9)10(13)8-4-3-5-8;1-10(2,3)9(13)11-7-5-4-6-8(11)12;11-8-3-1-2-6-10(8)9(12)7-4-5-7;7*1-3(7)11-2-4(5,6)12(8,9)10;;;;;;;/h11-13H,1-10H2;12H,1-11H2;10H,1-9H2;9H,1-8H2;8H,1-7H2;4-7H2,1-3H3;7H,1-6H2;7*2H,1H3,(H,8,9,10);;;;;;;/q;;;;;;;7*-1;;;;;;;/p-7.
What are the key properties of heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium)?
heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium) has a molecular weight of 4718.89 g/mol, XLogP of 12.23, 27 rotatable bonds, 0 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for heptakis(2-acetyloxy-1,1-difluoroethanesulfonate);1-(adamantane-1-carbonyl)piperidin-2-one;1-(cyclobutanecarbonyl)piperidin-2-one;1-(cyclohexanecarbonyl)piperidin-2-one;1-(cyclooctanecarbonyl)piperidin-2-one;1-(cyclopentanecarbonyl)piperidin-2-one;1-(cyclopropanecarbonyl)piperidin-2-one;1-(2,2-dimethylpropanoyl)piperidin-2-one;heptakis(rutherfordium) is sourced from PubChem (CID 161469447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).