2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide

C11H22N4O2 — CID 102656518

IUPAC2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide
SMILESCN1CCN(NC(=O)COC2(C)CNC2)CC1
InChIInChI=1S/C11H22N4O2/c1-11(8-12-9-11)17-7-10(16)13-15-5-3-14(2)4-6-15/h12H,3-9H2,1-2H3,(H,13,16)
InChIKeyQGOIMDNXMSIRKU-UHFFFAOYSA-N
MW242.32 g/mol
LogP-1.36
Rot. Bonds4

About 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide

2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide (PubChem CID 102656518) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide.

Molecular Properties

Compound Name2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide
PubChem CID102656518
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide
SMILESCN1CCN(NC(=O)COC2(C)CNC2)CC1
InChIInChI=1S/C11H22N4O2/c1-11(8-12-9-11)17-7-10(16)13-15-5-3-14(2)4-6-15/h12H,3-9H2,1-2H3,(H,13,16)
InChIKeyQGOIMDNXMSIRKU-UHFFFAOYSA-N
XLogP-1.36
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-1.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methylazetidin-3-yl)oxy-N-pyrrol-1-ylacetamide
CID 102656321
N-hydroxy-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656216
2-(3-methylazetidin-3-yl)oxyacetamide
CID 83065734
2-(3-methylazetidin-3-yl)oxy-N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
CID 102611904
2-(3-methylazetidin-3-yl)oxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)acetamide
CID 102611541
N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656490
N-[(2R)-2-hydroxypropyl]-2-(3-methylazetidin-3-yl)oxyacetamide
CID 107220953
N-(2,2-difluoroethyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611604
5-methoxy-2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]-5-oxopentanoic acid
CID 102656504
2-methyl-N-[2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]ethyl]propanamide
CID 102610917
N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611702
N-(4-methylpiperazin-1-yl)butanamide
CID 4129194

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide?
The IUPAC name of 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide (CID 102656518) is 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide.
What is the SMILES notation for 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide?
The canonical SMILES for 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide is CN1CCN(NC(=O)COC2(C)CNC2)CC1.
What is the InChIKey of 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide?
The InChIKey is QGOIMDNXMSIRKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-11(8-12-9-11)17-7-10(16)13-15-5-3-14(2)4-6-15/h12H,3-9H2,1-2H3,(H,13,16).
What are the key properties of 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide?
2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide has a molecular weight of 242.32 g/mol, XLogP of -1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylazetidin-3-yl)oxy-N-(4-methylpiperazin-1-yl)acetamide is sourced from PubChem (CID 102656518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).