(3E)-3-methoxyiminopiperidin-2-one

C6H10N2O2 — CID 20684411

IUPAC(3E)-3-methoxyiminopiperidin-2-one
SMILESCO/N=C1\CCCNC1=O
InChIInChI=1S/C6H10N2O2/c1-10-8-5-3-2-4-7-6(5)9/h2-4H2,1H3,(H,7,9)/b8-5+
InChIKeyCEZBBHYLTZIVEP-VMPITWQZSA-N
MW142.16 g/mol
LogP-0.10
Rot. Bonds1

About (3E)-3-methoxyiminopiperidin-2-one

(3E)-3-methoxyiminopiperidin-2-one (PubChem CID 20684411) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (3E)-3-methoxyiminopiperidin-2-one.

Molecular Properties

Compound Name(3E)-3-methoxyiminopiperidin-2-one
PubChem CID20684411
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(3E)-3-methoxyiminopiperidin-2-one
SMILESCO/N=C1\CCCNC1=O
InChIInChI=1S/C6H10N2O2/c1-10-8-5-3-2-4-7-6(5)9/h2-4H2,1H3,(H,7,9)/b8-5+
InChIKeyCEZBBHYLTZIVEP-VMPITWQZSA-N
XLogP-0.10
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3E)-3-methoxyiminopiperidin-2-one?
The IUPAC name of (3E)-3-methoxyiminopiperidin-2-one (CID 20684411) is (3E)-3-methoxyiminopiperidin-2-one.
What is the SMILES notation for (3E)-3-methoxyiminopiperidin-2-one?
The canonical SMILES for (3E)-3-methoxyiminopiperidin-2-one is CO/N=C1\CCCNC1=O.
What is the InChIKey of (3E)-3-methoxyiminopiperidin-2-one?
The InChIKey is CEZBBHYLTZIVEP-VMPITWQZSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-10-8-5-3-2-4-7-6(5)9/h2-4H2,1H3,(H,7,9)/b8-5+.
What are the key properties of (3E)-3-methoxyiminopiperidin-2-one?
(3E)-3-methoxyiminopiperidin-2-one has a molecular weight of 142.16 g/mol, XLogP of -0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-methoxyiminopiperidin-2-one is sourced from PubChem (CID 20684411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).