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

C12H22N2O2 — CID 102611512

IUPACN-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(CNC(=O)COC1(C)CNC1)C1CC1
InChIInChI=1S/C12H22N2O2/c1-9(10-3-4-10)5-14-11(15)6-16-12(2)7-13-8-12/h9-10,13H,3-8H2,1-2H3,(H,14,15)
InChIKeyXKLXIAIAHHFZHV-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.53
Rot. Bonds6

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

N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide (PubChem CID 102611512) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
PubChem CID102611512
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(CNC(=O)COC1(C)CNC1)C1CC1
InChIInChI=1S/C12H22N2O2/c1-9(10-3-4-10)5-14-11(15)6-16-12(2)7-13-8-12/h9-10,13H,3-8H2,1-2H3,(H,14,15)
InChIKeyXKLXIAIAHHFZHV-UHFFFAOYSA-N
XLogP0.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-hydroxypropyl]-2-(3-methylazetidin-3-yl)oxyacetamide
CID 107220953
N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611702
N-(2,2-difluoroethyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611604
N-(2-hydroxy-4-methylpentyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611709
N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656133
2-(3-methylazetidin-3-yl)oxy-N-(2-methyl-3-methylsulfanylpropyl)acetamide
CID 102611630
N-(2-hydroxybutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656602
4-methyl-2-[[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]methyl]pentanoic acid
CID 102656356
2-methyl-N-[2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]ethyl]propanamide
CID 102610917
2-(3-methylazetidin-3-yl)oxy-N-[(4-methylcyclohexyl)methyl]acetamide
CID 102656184
N-hydroxy-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656216
2-(3-methylazetidin-3-yl)oxy-N-[(2-methylcyclopropyl)methyl]acetamide
CID 102611285

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The IUPAC name of N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide (CID 102611512) is N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide.
What is the SMILES notation for N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The canonical SMILES for N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide is CC(CNC(=O)COC1(C)CNC1)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The InChIKey is XKLXIAIAHHFZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9(10-3-4-10)5-14-11(15)6-16-12(2)7-13-8-12/h9-10,13H,3-8H2,1-2H3,(H,14,15).
What are the key properties of N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide has a molecular weight of 226.32 g/mol, XLogP of 0.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide is sourced from PubChem (CID 102611512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).