N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide

C12H24N2O2 — CID 102611702

IUPACN-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(C)C(C)CNC(=O)COC1(C)CNC1
InChIInChI=1S/C12H24N2O2/c1-9(2)10(3)5-14-11(15)6-16-12(4)7-13-8-12/h9-10,13H,5-8H2,1-4H3,(H,14,15)
InChIKeyXVHRWZDPLFHIQM-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.77
Rot. Bonds6

About N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide

N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide (PubChem CID 102611702) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
PubChem CID102611702
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(C)C(C)CNC(=O)COC1(C)CNC1
InChIInChI=1S/C12H24N2O2/c1-9(2)10(3)5-14-11(15)6-16-12(4)7-13-8-12/h9-10,13H,5-8H2,1-4H3,(H,14,15)
InChIKeyXVHRWZDPLFHIQM-UHFFFAOYSA-N
XLogP0.77
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.77
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-(2,2-difluoroethyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611604
N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656133
N-(2-hydroxy-4-methylpentyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611709
N-(2-cyclopropylpropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611512
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
N-hydroxy-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656216
2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]ethyl carbamate
CID 102656535
N-(1-methoxypropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 83067654

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The IUPAC name of N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide (CID 102611702) is N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide.
What is the SMILES notation for N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The canonical SMILES for N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide is CC(C)C(C)CNC(=O)COC1(C)CNC1.
What is the InChIKey of N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The InChIKey is XVHRWZDPLFHIQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9(2)10(3)5-14-11(15)6-16-12(4)7-13-8-12/h9-10,13H,5-8H2,1-4H3,(H,14,15).
What are the key properties of N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide has a molecular weight of 228.34 g/mol, XLogP of 0.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide is sourced from PubChem (CID 102611702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).