carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)

C16H25ClN2U — CID 155702967

IUPACcarbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)
SMILESCC.NC1c2cc(Cl)[c-]cc2CC12CCNCC2.[CH3-].[U+2]
InChIInChI=1S/C13H16ClN2.C2H6.CH3.U/c14-10-2-1-9-8-13(3-5-16-6-4-13)12(15)11(9)7-10;1-2;;/h1,7,12,16H,3-6,8,15H2;1-2H3;1H3;/q-1;;-1;+2
InChIKeyDNJCGIARQJHCAD-UHFFFAOYSA-N
MW518.87 g/mol
LogP3.54
Rot. Bonds

About carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)

carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+) (PubChem CID 155702967) has the molecular formula C16H25ClN2U and a molecular weight of 518.87 g/mol. Its IUPAC name is carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+).

Molecular Properties

Compound Namecarbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)
PubChem CID155702967
Molecular FormulaC16H25ClN2U
Molecular Weight518.87 g/mol
Exact Mass518.22
IUPAC Namecarbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)
SMILESCC.NC1c2cc(Cl)[c-]cc2CC12CCNCC2.[CH3-].[U+2]
InChIInChI=1S/C13H16ClN2.C2H6.CH3.U/c14-10-2-1-9-8-13(3-5-16-6-4-13)12(15)11(9)7-10;1-2;;/h1,7,12,16H,3-6,8,15H2;1-2H3;1H3;/q-1;;-1;+2
InChIKeyDNJCGIARQJHCAD-UHFFFAOYSA-N
XLogP3.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500518.87
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+) with MolForge

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Related Compounds

6-bromospiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 175083255
(1S)-spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 139512047
(1S)-4-fluorospiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 139512170
1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile
CID 139512061
(5S)-spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;trihydrochloride
CID 153482804
(1S)-4-fluorospiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;hydrochloride
CID 169080151
spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;dihydrochloride
CID 155165273
spiro[1,3-dihydrocyclopenta[a]naphthalene-2,4'-piperidine]-3-amine
CID 155649427
3-methylspiro[4,6-dihydrocyclopenta[d]imidazole-5,4'-piperidine]-4-amine
CID 172722506
8-azaspiro[4.5]dec-2-en-4-amine
CID 150421355
3-(tert-butylsulfanylamino)spiro[1,3-dihydroindene-2,4'-piperidine]-5-carbonitrile
CID 167048203
3-amino-1'-propan-2-ylspiro[1,3-dihydroindene-2,4'-piperidine]-5-ol
CID 167307365

Frequently Asked Questions

What is the IUPAC name of carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)?
The IUPAC name of carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+) (CID 155702967) is carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+).
What is the SMILES notation for carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)?
The canonical SMILES for carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+) is CC.NC1c2cc(Cl)[c-]cc2CC12CCNCC2.[CH3-].[U+2].
What is the InChIKey of carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)?
The InChIKey is DNJCGIARQJHCAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN2.C2H6.CH3.U/c14-10-2-1-9-8-13(3-5-16-6-4-13)12(15)11(9)7-10;1-2;;/h1,7,12,16H,3-6,8,15H2;1-2H3;1H3;/q-1;;-1;+2.
What are the key properties of carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+)?
carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+) has a molecular weight of 518.87 g/mol, XLogP of 3.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;6-chlorospiro[3,5-dihydro-1H-inden-5-ide-2,4'-piperidine]-1-amine;ethane;uranium(2+) is sourced from PubChem (CID 155702967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).