argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)

C40H100Ar9N4Y9-2 — CID 163640351

IUPACargon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)
SMILESC.C.C.CC.CC.CC.CC.CC(C)N1CCCC1.CC1(C)CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[CH3-].[CH3-].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
InChIInChI=1S/C11H23N.C9H20N2.C7H15N.4C2H6.3CH4.2CH3.9Ar.9Y/c1-10(2,3)12-8-6-11(4,5)7-9-12;1-9(2,3)11-7-5-10(4)6-8-11;1-7(2)8-5-3-4-6-8;4*1-2;;;;;;;;;;;;;;;;;;;;;;;/h6-9H2,1-5H3;5-8H2,1-4H3;7H,3-6H2,1-2H3;4*1-2H3;3*1H4;2*1H3;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;2*-1;;;;;;;;;;;;;;;;;;
InChIKeyUZISYCIYQJKCKP-UHFFFAOYSA-N
MW1796.95 g/mol
LogP12.32
Rot. Bonds1

About argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)

argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium) (PubChem CID 163640351) has the molecular formula C40H100Ar9N4Y9-2 and a molecular weight of 1796.95 g/mol. Its IUPAC name is argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium).

Molecular Properties

Compound Nameargon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)
PubChem CID163640351
Molecular FormulaC40H100Ar9N4Y9-2
Molecular Weight1796.95 g/mol
Exact Mass1796.61
IUPAC Nameargon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)
SMILESC.C.C.CC.CC.CC.CC.CC(C)N1CCCC1.CC1(C)CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[CH3-].[CH3-].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
InChIInChI=1S/C11H23N.C9H20N2.C7H15N.4C2H6.3CH4.2CH3.9Ar.9Y/c1-10(2,3)12-8-6-11(4,5)7-9-12;1-9(2,3)11-7-5-10(4)6-8-11;1-7(2)8-5-3-4-6-8;4*1-2;;;;;;;;;;;;;;;;;;;;;;;/h6-9H2,1-5H3;5-8H2,1-4H3;7H,3-6H2,1-2H3;4*1-2H3;3*1H4;2*1H3;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;2*-1;;;;;;;;;;;;;;;;;;
InChIKeyUZISYCIYQJKCKP-UHFFFAOYSA-N
XLogP12.32
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001796.95
LogP ≤ 512.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

carbanide;4,4-dimethyl-1-propan-2-ylpiperidine;ethane;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylpyrrolidine;nonakis(yttrium)
CID 163857850
1-tert-butyl-4-methyl-1,4-diazepane;1-tert-butyl-4-methylpiperazine;1-propan-2-ylpiperidine
CID 161180929
1-tert-butyl-4,7-dimethyl-1,4,7-triazonane;1,4-dimethyl-7-propan-2-yl-1,4,7-triazonane
CID 158395030
1-tert-butylpyrrolidine;cyclopentane;ethane;methane;bis(2-methylpropane);1-methylpyrrolidine
CID 159350660
1-tert-butyl-4-methylpiperazine;1-tert-butylpiperidine
CID 156749865
1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylazepane
CID 170616932
ethane;1-methylazepane;1-propan-2-ylpiperidine
CID 170601993
1-tert-butyl-4,7,10-trimethyl-1,4,7,10-tetrazacyclododecane;methane;zinc
CID 162271168
ethane;1-propan-2-ylpyrrolidine
CID 167557798
ethane;methane;1-propan-2-ylazetidine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 167622043
ethane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 177140338
1,4-dimethyl-7-propan-2-yl-1,4,7-triazonane
CID 157390684

Frequently Asked Questions

What is the IUPAC name of argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)?
The IUPAC name of argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium) (CID 163640351) is argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium).
What is the SMILES notation for argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)?
The canonical SMILES for argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium) is C.C.C.CC.CC.CC.CC.CC(C)N1CCCC1.CC1(C)CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[Ar].[CH3-].[CH3-].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].
What is the InChIKey of argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)?
The InChIKey is UZISYCIYQJKCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.C9H20N2.C7H15N.4C2H6.3CH4.2CH3.9Ar.9Y/c1-10(2,3)12-8-6-11(4,5)7-9-12;1-9(2,3)11-7-5-10(4)6-8-11;1-7(2)8-5-3-4-6-8;4*1-2;;;;;;;;;;;;;;;;;;;;;;;/h6-9H2,1-5H3;5-8H2,1-4H3;7H,3-6H2,1-2H3;4*1-2H3;3*1H4;2*1H3;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;2*-1;;;;;;;;;;;;;;;;;;.
What are the key properties of argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium)?
argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium) has a molecular weight of 1796.95 g/mol, XLogP of 12.32, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for argon;1-tert-butyl-4,4-dimethylpiperidine;1-tert-butyl-4-methylpiperazine;carbanide;ethane;methane;1-propan-2-ylpyrrolidine;nonakis(yttrium) is sourced from PubChem (CID 163640351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).