5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)

C14H28N2U — CID 59783764

IUPAC5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)
SMILESCC(C)(C)N1CC2CC[N-]C2C1.C[C-](C)C.[U+2]
InChIInChI=1S/C10H19N2.C4H9.U/c1-10(2,3)12-6-8-4-5-11-9(8)7-12;1-4(2)3;/h8-9H,4-7H2,1-3H3;1-3H3;/q2*-1;+2
InChIKeyUQBRPHJVSBPAQZ-UHFFFAOYSA-N
MW462.42 g/mol
LogP3.48
Rot. Bonds

About 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)

5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+) (PubChem CID 59783764) has the molecular formula C14H28N2U and a molecular weight of 462.42 g/mol. Its IUPAC name is 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+).

Molecular Properties

Compound Name5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)
PubChem CID59783764
Molecular FormulaC14H28N2U
Molecular Weight462.42 g/mol
Exact Mass462.28
IUPAC Name5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)
SMILESCC(C)(C)N1CC2CC[N-]C2C1.C[C-](C)C.[U+2]
InChIInChI=1S/C10H19N2.C4H9.U/c1-10(2,3)12-6-8-4-5-11-9(8)7-12;1-4(2)3;/h8-9H,4-7H2,1-3H3;1-3H3;/q2*-1;+2
InChIKeyUQBRPHJVSBPAQZ-UHFFFAOYSA-N
XLogP3.48
TPSA17.34 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.42
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3aR,7aS)-2-tert-butyl-1,3,3a,4,5,6,7,7a-octahydroisoindole
CID 58968201
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CID 59777280
potassium 5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide
CID 171744429
potassium tert-butyl 2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide-5-carboxylate
CID 145242253
3-tert-butyl-3-azabicyclo[3.2.1]octan-8-ol
CID 43810977
(3aR,6aS)-5-tert-butyl-2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 90292242
5-tert-butyl-2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 22943643
5-tert-butyl-2,3,3a,4,6,6a-hexahydrofuro[2,3-c]pyrrole
CID 118901666
(1R,6S)-8-tert-butyl-8-azabicyclo[4.3.1]decan-10-ol
CID 139039444
3-tert-butyl-3-azabicyclo[3.3.1]nonan-9-amine
CID 43810988
3-tert-butyl-3-aza-8-azanidabicyclo[3.2.1]octane;rubidium(1+)
CID 59777249
2-tert-butyl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-c]azepine
CID 126571223

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)?
The IUPAC name of 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+) (CID 59783764) is 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+).
What is the SMILES notation for 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)?
The canonical SMILES for 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+) is CC(C)(C)N1CC2CC[N-]C2C1.C[C-](C)C.[U+2].
What is the InChIKey of 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)?
The InChIKey is UQBRPHJVSBPAQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N2.C4H9.U/c1-10(2,3)12-6-8-4-5-11-9(8)7-12;1-4(2)3;/h8-9H,4-7H2,1-3H3;1-3H3;/q2*-1;+2.
What are the key properties of 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+)?
5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+) has a molecular weight of 462.42 g/mol, XLogP of 3.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-ide;2-methylpropane;uranium(2+) is sourced from PubChem (CID 59783764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).