N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)

C10H19N2U+ — CID 18737137

IUPACN-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)
SMILES[CH2-]CN(C=[N+]1CCCCC1)C[CH2-].[U+2]
InChIInChI=1S/C10H19N2.U/c1-3-11(4-2)10-12-8-6-5-7-9-12;/h10H,1-9H2;/q-1;+2
InChIKeyBAEQNQQAJYJZTE-UHFFFAOYSA-N
MW405.31 g/mol
LogP1.18
Rot. Bonds3

About N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)

N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+) (PubChem CID 18737137) has the molecular formula C10H19N2U+ and a molecular weight of 405.31 g/mol. Its IUPAC name is N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+).

Molecular Properties

Compound NameN-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)
PubChem CID18737137
Molecular FormulaC10H19N2U+
Molecular Weight405.31 g/mol
Exact Mass405.21
IUPAC NameN-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)
SMILES[CH2-]CN(C=[N+]1CCCCC1)C[CH2-].[U+2]
InChIInChI=1S/C10H19N2.U/c1-3-11(4-2)10-12-8-6-5-7-9-12;/h10H,1-9H2;/q-1;+2
InChIKeyBAEQNQQAJYJZTE-UHFFFAOYSA-N
XLogP1.18
TPSA6.25 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.31
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)?
The IUPAC name of N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+) (CID 18737137) is N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+).
What is the SMILES notation for N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)?
The canonical SMILES for N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+) is [CH2-]CN(C=[N+]1CCCCC1)C[CH2-].[U+2].
What is the InChIKey of N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)?
The InChIKey is BAEQNQQAJYJZTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N2.U/c1-3-11(4-2)10-12-8-6-5-7-9-12;/h10H,1-9H2;/q-1;+2.
What are the key properties of N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+)?
N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+) has a molecular weight of 405.31 g/mol, XLogP of 1.18, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(piperidin-1-ium-1-ylidenemethyl)ethanamine;uranium(2+) is sourced from PubChem (CID 18737137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).