carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)

C18H22N2O3U — CID 18685828

IUPACcarbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)
SMILESCC(=O)C(C)C(C)NC(=O)c1cn(C)c2c[c-]ccc2c1=O.[CH3-].[U+2]
InChIInChI=1S/C17H19N2O3.CH3.U/c1-10(12(3)20)11(2)18-17(22)14-9-19(4)15-8-6-5-7-13(15)16(14)21;;/h5,7-11H,1-4H3,(H,18,22);1H3;/q2*-1;+2
InChIKeyAYNMYBNZLSXVRY-UHFFFAOYSA-N
MW552.41 g/mol
LogP2.13
Rot. Bonds4

About carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)

carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+) (PubChem CID 18685828) has the molecular formula C18H22N2O3U and a molecular weight of 552.41 g/mol. Its IUPAC name is carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+).

Molecular Properties

Compound Namecarbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)
PubChem CID18685828
Molecular FormulaC18H22N2O3U
Molecular Weight552.41 g/mol
Exact Mass552.21
IUPAC Namecarbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)
SMILESCC(=O)C(C)C(C)NC(=O)c1cn(C)c2c[c-]ccc2c1=O.[CH3-].[U+2]
InChIInChI=1S/C17H19N2O3.CH3.U/c1-10(12(3)20)11(2)18-17(22)14-9-19(4)15-8-6-5-7-13(15)16(14)21;;/h5,7-11H,1-4H3,(H,18,22);1H3;/q2*-1;+2
InChIKeyAYNMYBNZLSXVRY-UHFFFAOYSA-N
XLogP2.13
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500552.41
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)?
The IUPAC name of carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+) (CID 18685828) is carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+).
What is the SMILES notation for carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)?
The canonical SMILES for carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+) is CC(=O)C(C)C(C)NC(=O)c1cn(C)c2c[c-]ccc2c1=O.[CH3-].[U+2].
What is the InChIKey of carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)?
The InChIKey is AYNMYBNZLSXVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N2O3.CH3.U/c1-10(12(3)20)11(2)18-17(22)14-9-19(4)15-8-6-5-7-13(15)16(14)21;;/h5,7-11H,1-4H3,(H,18,22);1H3;/q2*-1;+2.
What are the key properties of carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+)?
carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+) has a molecular weight of 552.41 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1-methyl-N-(3-methyl-4-oxopentan-2-yl)-4-oxo-7H-quinolin-7-ide-3-carboxamide;uranium(2+) is sourced from PubChem (CID 18685828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).