N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide

C14H20N2O2 — CID 64974289

IUPACN-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide
SMILESCCN(C(=O)CNOCc1ccccc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-16(13-8-9-13)14(17)10-15-18-11-12-6-4-3-5-7-12/h3-7,13,15H,2,8-11H2,1H3
InChIKeyUSPPCVFZPJOGGN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.72
Rot. Bonds7

About N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide

N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide (PubChem CID 64974289) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide
PubChem CID64974289
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide
SMILESCCN(C(=O)CNOCc1ccccc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-16(13-8-9-13)14(17)10-15-18-11-12-6-4-3-5-7-12/h3-7,13,15H,2,8-11H2,1H3
InChIKeyUSPPCVFZPJOGGN-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide (CID 64974289) is N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide is CCN(C(=O)CNOCc1ccccc1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide?
The InChIKey is USPPCVFZPJOGGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-16(13-8-9-13)14(17)10-15-18-11-12-6-4-3-5-7-12/h3-7,13,15H,2,8-11H2,1H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide?
N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.72, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-(phenylmethoxyamino)acetamide is sourced from PubChem (CID 64974289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).