3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)

C11H21NU — CID 59783806

IUPAC3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)
SMILESC1CC2CC[N-]C2C1.C[C-](C)C.[U+2]
InChIInChI=1S/C7H12N.C4H9.U/c1-2-6-4-5-8-7(6)3-1;1-4(2)3;/h6-7H,1-5H2;1-3H3;/q2*-1;+2
InChIKeyDFPVDIWKBPAFKR-UHFFFAOYSA-N
MW405.33 g/mol
LogP3.55
Rot. Bonds

About 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)

3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+) (PubChem CID 59783806) has the molecular formula C11H21NU and a molecular weight of 405.33 g/mol. Its IUPAC name is 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+).

Molecular Properties

Compound Name3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)
PubChem CID59783806
Molecular FormulaC11H21NU
Molecular Weight405.33 g/mol
Exact Mass405.22
IUPAC Name3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)
SMILESC1CC2CC[N-]C2C1.C[C-](C)C.[U+2]
InChIInChI=1S/C7H12N.C4H9.U/c1-2-6-4-5-8-7(6)3-1;1-4(2)3;/h6-7H,1-5H2;1-3H3;/q2*-1;+2
InChIKeyDFPVDIWKBPAFKR-UHFFFAOYSA-N
XLogP3.55
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.33
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+) with MolForge

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Related Compounds

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CID 59783764
2,3,3a,4,5,6,7,7a-octahydropyrrolo[3,2-c]pyridin-1-ide;tungsten
CID 155621611
tricyclo[11.3.0.05,9]hexadecane
CID 154595560
1,2,3,3a,4,5,6,6a-octahydropentalene;cyclopentane;ethane
CID 161297906
1,2,3,3a,4,5,6,6a-octahydropentalene;phosphane
CID 174450452
(1R,5R)-bicyclo[3.2.0]heptane
CID 123536914
bis(2,3,3a,4,5,6,7,7a-octahydro-1H-indene);tetrakis(1,2,3,3a,4,5,6,6a-octahydropentalene);hexakis(2-methylpropane)
CID 161375940
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CID 58552309
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1,2,3,3a,4,5,6,6a-octahydropentalene;cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane;cyclopropane
CID 158726060
(3aR,12aR)-1,2,3,3a,4,5,6,7,8,9,10,11,12,12a-tetradecahydrocyclopenta[11]annulene
CID 14112261
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-ylazanide;dichloropalladium
CID 54604434

Frequently Asked Questions

What is the IUPAC name of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)?
The IUPAC name of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+) (CID 59783806) is 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+).
What is the SMILES notation for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)?
The canonical SMILES for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+) is C1CC2CC[N-]C2C1.C[C-](C)C.[U+2].
What is the InChIKey of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)?
The InChIKey is DFPVDIWKBPAFKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N.C4H9.U/c1-2-6-4-5-8-7(6)3-1;1-4(2)3;/h6-7H,1-5H2;1-3H3;/q2*-1;+2.
What are the key properties of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+)?
3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+) has a molecular weight of 405.33 g/mol, XLogP of 3.55, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ide;2-methylpropane;uranium(2+) is sourced from PubChem (CID 59783806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).