azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)

C22H30N3UY2- — CID 177350806

IUPACazanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)
SMILESC1C[N-]1.CCc1ccc(C2CC[N-]CC2)cc1.[NH-]Cc1ccccc1.[U+2].[Y].[Y]
InChIInChI=1S/C13H18N.C7H8N.C2H4N.U.2Y/c1-2-11-3-5-12(6-4-11)13-7-9-14-10-8-13;8-6-7-4-2-1-3-5-7;1-2-3-1;;;/h3-6,13H,2,7-10H2,1H3;1-5,8H,6H2;1-2H2;;;/q3*-1;+2;;
InChIKeyZBRIKSNAJLVROO-UHFFFAOYSA-N
MW752.34 g/mol
LogP6.11
Rot. Bonds3

About azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)

azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium) (PubChem CID 177350806) has the molecular formula C22H30N3UY2- and a molecular weight of 752.34 g/mol. Its IUPAC name is azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium).

Molecular Properties

Compound Nameazanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)
PubChem CID177350806
Molecular FormulaC22H30N3UY2-
Molecular Weight752.34 g/mol
Exact Mass752.11
IUPAC Nameazanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)
SMILESC1C[N-]1.CCc1ccc(C2CC[N-]CC2)cc1.[NH-]Cc1ccccc1.[U+2].[Y].[Y]
InChIInChI=1S/C13H18N.C7H8N.C2H4N.U.2Y/c1-2-11-3-5-12(6-4-11)13-7-9-14-10-8-13;8-6-7-4-2-1-3-5-7;1-2-3-1;;;/h3-6,13H,2,7-10H2,1H3;1-5,8H,6H2;1-2H2;;;/q3*-1;+2;;
InChIKeyZBRIKSNAJLVROO-UHFFFAOYSA-N
XLogP6.11
TPSA52.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500752.34
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)?
The IUPAC name of azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium) (CID 177350806) is azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium).
What is the SMILES notation for azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)?
The canonical SMILES for azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium) is C1C[N-]1.CCc1ccc(C2CC[N-]CC2)cc1.[NH-]Cc1ccccc1.[U+2].[Y].[Y].
What is the InChIKey of azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)?
The InChIKey is ZBRIKSNAJLVROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N.C7H8N.C2H4N.U.2Y/c1-2-11-3-5-12(6-4-11)13-7-9-14-10-8-13;8-6-7-4-2-1-3-5-7;1-2-3-1;;;/h3-6,13H,2,7-10H2,1H3;1-5,8H,6H2;1-2H2;;;/q3*-1;+2;;.
What are the key properties of azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium)?
azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium) has a molecular weight of 752.34 g/mol, XLogP of 6.11, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for azanidacyclopropane;benzylazanide;4-(4-ethylphenyl)piperidin-1-ide;uranium(2+);bis(yttrium) is sourced from PubChem (CID 177350806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).