2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide

C11H22N2O3 — CID 64609560

IUPAC2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
SMILESCOCCOCCCNC(=O)CC1CNC1
InChIInChI=1S/C11H22N2O3/c1-15-5-6-16-4-2-3-13-11(14)7-10-8-12-9-10/h10,12H,2-9H2,1H3,(H,13,14)
InChIKeyAKVLXXFIVWVYHC-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.23
Rot. Bonds9

About 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide

2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide (PubChem CID 64609560) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
PubChem CID64609560
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
SMILESCOCCOCCCNC(=O)CC1CNC1
InChIInChI=1S/C11H22N2O3/c1-15-5-6-16-4-2-3-13-11(14)7-10-8-12-9-10/h10,12H,2-9H2,1H3,(H,13,14)
InChIKeyAKVLXXFIVWVYHC-UHFFFAOYSA-N
XLogP-0.23
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide (CID 64609560) is 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide is COCCOCCCNC(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide?
The InChIKey is AKVLXXFIVWVYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-15-5-6-16-4-2-3-13-11(14)7-10-8-12-9-10/h10,12H,2-9H2,1H3,(H,13,14).
What are the key properties of 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide?
2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide has a molecular weight of 230.31 g/mol, XLogP of -0.23, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide is sourced from PubChem (CID 64609560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).