(3E)-3-methoxyimino-N-methylpropanamide

C5H10N2O2 — CID 59782637

IUPAC(3E)-3-methoxyimino-N-methylpropanamide
SMILESCNC(=O)C/C=N/OC
InChIInChI=1S/C5H10N2O2/c1-6-5(8)3-4-7-9-2/h4H,3H2,1-2H3,(H,6,8)/b7-4+
InChIKeyBECCESVVRJBDBO-QPJJXVBHSA-N
MW130.15 g/mol
LogP-0.25
Rot. Bonds3

About (3E)-3-methoxyimino-N-methylpropanamide

(3E)-3-methoxyimino-N-methylpropanamide (PubChem CID 59782637) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is (3E)-3-methoxyimino-N-methylpropanamide.

Molecular Properties

Compound Name(3E)-3-methoxyimino-N-methylpropanamide
PubChem CID59782637
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name(3E)-3-methoxyimino-N-methylpropanamide
SMILESCNC(=O)C/C=N/OC
InChIInChI=1S/C5H10N2O2/c1-6-5(8)3-4-7-9-2/h4H,3H2,1-2H3,(H,6,8)/b7-4+
InChIKeyBECCESVVRJBDBO-QPJJXVBHSA-N
XLogP-0.25
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.25
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'}

Analyze (3E)-3-methoxyimino-N-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3E)-3-methoxyimino-N-methylpropanamide?
The IUPAC name of (3E)-3-methoxyimino-N-methylpropanamide (CID 59782637) is (3E)-3-methoxyimino-N-methylpropanamide.
What is the SMILES notation for (3E)-3-methoxyimino-N-methylpropanamide?
The canonical SMILES for (3E)-3-methoxyimino-N-methylpropanamide is CNC(=O)C/C=N/OC.
What is the InChIKey of (3E)-3-methoxyimino-N-methylpropanamide?
The InChIKey is BECCESVVRJBDBO-QPJJXVBHSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-6-5(8)3-4-7-9-2/h4H,3H2,1-2H3,(H,6,8)/b7-4+.
What are the key properties of (3E)-3-methoxyimino-N-methylpropanamide?
(3E)-3-methoxyimino-N-methylpropanamide has a molecular weight of 130.15 g/mol, XLogP of -0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-methoxyimino-N-methylpropanamide is sourced from PubChem (CID 59782637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).