azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))

C28H51N6O8Rb3 — CID 160649069

IUPACazanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))
SMILESCC(C)(C)OC(=O)N1CCCC(C(=O)O)C1.CC(C)(C)OC(=O)N1CCCC(C([NH-])=O)C1.[NH-]C(=O)C1CCCNC1.[NH2-].[Rb+].[Rb+].[Rb+]
InChIInChI=1S/C11H20N2O3.C11H19NO4.C6H12N2O.H2N.3Rb/c1-11(2,3)16-10(15)13-6-4-5-8(7-13)9(12)14;1-11(2,3)16-10(15)12-6-4-5-8(7-12)9(13)14;7-6(9)5-2-1-3-8-4-5;;;;/h8H,4-7H2,1-3H3,(H2,12,14);8H,4-7H2,1-3H3,(H,13,14);5,8H,1-4H2,(H2,7,9);1H2;;;/q;;;-1;3*+1/p-2
InChIKeyRKEGAKPAAOLUTF-UHFFFAOYSA-L
MW856.15 g/mol
LogP-3.78
Rot. Bonds3

About azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))

azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)) (PubChem CID 160649069) has the molecular formula C28H51N6O8Rb3 and a molecular weight of 856.15 g/mol. Its IUPAC name is azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)).

Molecular Properties

Compound Nameazanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))
PubChem CID160649069
Molecular FormulaC28H51N6O8Rb3
Molecular Weight856.15 g/mol
Exact Mass854.11
IUPAC Nameazanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))
SMILESCC(C)(C)OC(=O)N1CCCC(C(=O)O)C1.CC(C)(C)OC(=O)N1CCCC(C([NH-])=O)C1.[NH-]C(=O)C1CCCNC1.[NH2-].[Rb+].[Rb+].[Rb+]
InChIInChI=1S/C11H20N2O3.C11H19NO4.C6H12N2O.H2N.3Rb/c1-11(2,3)16-10(15)13-6-4-5-8(7-13)9(12)14;1-11(2,3)16-10(15)12-6-4-5-8(7-12)9(13)14;7-6(9)5-2-1-3-8-4-5;;;;/h8H,4-7H2,1-3H3,(H2,12,14);8H,4-7H2,1-3H3,(H,13,14);5,8H,1-4H2,(H2,7,9);1H2;;;/q;;;-1;3*+1/p-2
InChIKeyRKEGAKPAAOLUTF-UHFFFAOYSA-L
XLogP-3.78
TPSA223.65 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms45
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500856.15
LogP ≤ 5-3.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))?
The IUPAC name of azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)) (CID 160649069) is azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)).
What is the SMILES notation for azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))?
The canonical SMILES for azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)) is CC(C)(C)OC(=O)N1CCCC(C(=O)O)C1.CC(C)(C)OC(=O)N1CCCC(C([NH-])=O)C1.[NH-]C(=O)C1CCCNC1.[NH2-].[Rb+].[Rb+].[Rb+].
What is the InChIKey of azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))?
The InChIKey is RKEGAKPAAOLUTF-UHFFFAOYSA-L. The full InChI is InChI=1S/C11H20N2O3.C11H19NO4.C6H12N2O.H2N.3Rb/c1-11(2,3)16-10(15)13-6-4-5-8(7-13)9(12)14;1-11(2,3)16-10(15)12-6-4-5-8(7-12)9(13)14;7-6(9)5-2-1-3-8-4-5;;;;/h8H,4-7H2,1-3H3,(H2,12,14);8H,4-7H2,1-3H3,(H,13,14);5,8H,1-4H2,(H2,7,9);1H2;;;/q;;;-1;3*+1/p-2.
What are the key properties of azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+))?
azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)) has a molecular weight of 856.15 g/mol, XLogP of -3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carbonyl]azanide;1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;piperidine-3-carbonylazanide;tris(rubidium(1+)) is sourced from PubChem (CID 160649069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).