2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide

C12H24N2O2 — CID 116677912

IUPAC2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide
SMILESCCOCCN(CC)C(=O)C(C)C1CNC1
InChIInChI=1S/C12H24N2O2/c1-4-14(6-7-16-5-2)12(15)10(3)11-8-13-9-11/h10-11,13H,4-9H2,1-3H3
InChIKeyDTRZLTKHQNQFSR-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.73
Rot. Bonds7

About 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide

2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide (PubChem CID 116677912) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide
PubChem CID116677912
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide
SMILESCCOCCN(CC)C(=O)C(C)C1CNC1
InChIInChI=1S/C12H24N2O2/c1-4-14(6-7-16-5-2)12(15)10(3)11-8-13-9-11/h10-11,13H,4-9H2,1-3H3
InChIKeyDTRZLTKHQNQFSR-UHFFFAOYSA-N
XLogP0.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(azetidin-3-yl)-N-ethyl-N-(3-hydroxypropyl)propanamide
CID 116678990
N-(2-ethoxyethyl)-N-ethyl-2-piperazin-1-ylpropanamide
CID 63691474
2-(azetidin-3-yl)-N-ethyl-N-(2-phenylethyl)propanamide
CID 116676512
(2R)-2-amino-N-(2-ethoxyethyl)-N-ethyl-3-methylbutanamide
CID 79013546
(2S,3S)-2-amino-N-(2-ethoxyethyl)-N-ethyl-3-methylpentanamide
CID 63690931
2-(azetidin-3-yl)-N-butan-2-yl-N-ethylpropanamide
CID 116674787
2-amino-N-(2-ethoxyethyl)-N-ethyl-2-(oxan-4-yl)acetamide;hydrochloride
CID 120790311
N-(2-ethoxyethyl)-N-ethylcyclopropanecarboxamide
CID 63717858
(2S)-2-amino-N-(2-ethoxyethyl)-N-ethylpentanamide
CID 107569737
2-(azetidin-3-yl)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
CID 116674963
2-(azetidin-3-yl)-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)propanamide
CID 107479460
2-(azetidin-3-yl)-N-methyl-N-pentan-2-ylpropanamide
CID 116674919

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide (CID 116677912) is 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide is CCOCCN(CC)C(=O)C(C)C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide?
The InChIKey is DTRZLTKHQNQFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-14(6-7-16-5-2)12(15)10(3)11-8-13-9-11/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide?
2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide has a molecular weight of 228.34 g/mol, XLogP of 0.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(2-ethoxyethyl)-N-ethylpropanamide is sourced from PubChem (CID 116677912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).