N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide

C10H20N2O2 — CID 83065906

IUPACN-butyl-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCCCCNC(=O)COC1(C)CNC1
InChIInChI=1S/C10H20N2O2/c1-3-4-5-12-9(13)6-14-10(2)7-11-8-10/h11H,3-8H2,1-2H3,(H,12,13)
InChIKeyWGESEAPULYSMLD-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.28
Rot. Bonds6

About N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide

N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide (PubChem CID 83065906) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-butyl-2-(3-methylazetidin-3-yl)oxyacetamide
PubChem CID83065906
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-butyl-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCCCCNC(=O)COC1(C)CNC1
InChIInChI=1S/C10H20N2O2/c1-3-4-5-12-9(13)6-14-10(2)7-11-8-10/h11H,3-8H2,1-2H3,(H,12,13)
InChIKeyWGESEAPULYSMLD-UHFFFAOYSA-N
XLogP0.28
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide?
The IUPAC name of N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide (CID 83065906) is N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide.
What is the SMILES notation for N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide?
The canonical SMILES for N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide is CCCCNC(=O)COC1(C)CNC1.
What is the InChIKey of N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide?
The InChIKey is WGESEAPULYSMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-4-5-12-9(13)6-14-10(2)7-11-8-10/h11H,3-8H2,1-2H3,(H,12,13).
What are the key properties of N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide?
N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(3-methylazetidin-3-yl)oxyacetamide is sourced from PubChem (CID 83065906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).