2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide

C13H24N2O2 — CID 102611433

IUPAC2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide
SMILESCC1(NC(=O)COC2(C)CNC2)CCCCC1
InChIInChI=1S/C13H24N2O2/c1-12(6-4-3-5-7-12)15-11(16)8-17-13(2)9-14-10-13/h14H,3-10H2,1-2H3,(H,15,16)
InChIKeyZTPHRABSRORVDH-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.20
Rot. Bonds4

About 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide

2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide (PubChem CID 102611433) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide
PubChem CID102611433
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide
SMILESCC1(NC(=O)COC2(C)CNC2)CCCCC1
InChIInChI=1S/C13H24N2O2/c1-12(6-4-3-5-7-12)15-11(16)8-17-13(2)9-14-10-13/h14H,3-10H2,1-2H3,(H,15,16)
InChIKeyZTPHRABSRORVDH-UHFFFAOYSA-N
XLogP1.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide?
The IUPAC name of 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide (CID 102611433) is 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide is CC1(NC(=O)COC2(C)CNC2)CCCCC1.
What is the InChIKey of 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide?
The InChIKey is ZTPHRABSRORVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-12(6-4-3-5-7-12)15-11(16)8-17-13(2)9-14-10-13/h14H,3-10H2,1-2H3,(H,15,16).
What are the key properties of 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide?
2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide has a molecular weight of 240.35 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide is sourced from PubChem (CID 102611433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).