N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide

C10H20N2O4 — CID 102656490

IUPACN-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(CO)(CO)NC(=O)COC1(C)CNC1
InChIInChI=1S/C10H20N2O4/c1-9(6-13,7-14)12-8(15)3-16-10(2)4-11-5-10/h11,13-14H,3-7H2,1-2H3,(H,12,15)
InChIKeyGYPWPGXLVMYONW-UHFFFAOYSA-N
MW232.28 g/mol
LogP-1.78
Rot. Bonds6

About N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide

N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide (PubChem CID 102656490) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide
PubChem CID102656490
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC NameN-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(CO)(CO)NC(=O)COC1(C)CNC1
InChIInChI=1S/C10H20N2O4/c1-9(6-13,7-14)12-8(15)3-16-10(2)4-11-5-10/h11,13-14H,3-7H2,1-2H3,(H,12,15)
InChIKeyGYPWPGXLVMYONW-UHFFFAOYSA-N
XLogP-1.78
TPSA90.82 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 5-1.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methylazetidin-3-yl)oxy-N-(2-methylbut-3-yn-2-yl)acetamide
CID 102656217
N-hydroxy-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656216
N-tert-butyl-3-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]propanamide
CID 102611576
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-(3-methylazetidin-3-yl)oxyacetamide
CID 106255080
2-(3-methylazetidin-3-yl)oxyacetamide
CID 83065734
5,5-dimethyl-3-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]hexanoic acid
CID 102656607
N-[(2R)-2-hydroxypropyl]-2-(3-methylazetidin-3-yl)oxyacetamide
CID 107220953
2-(3-methylazetidin-3-yl)oxy-N-(1-methylcyclohexyl)acetamide
CID 102611433
N-(2,2-difluoroethyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611604
N-(2-ethyl-2-methylsulfanylbutyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611730
N-(1-hydroxypentan-3-yl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102656606
2-methyl-N-[2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]ethyl]propanamide
CID 102610917

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The IUPAC name of N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide (CID 102656490) is N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide.
What is the SMILES notation for N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The canonical SMILES for N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide is CC(CO)(CO)NC(=O)COC1(C)CNC1.
What is the InChIKey of N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The InChIKey is GYPWPGXLVMYONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-9(6-13,7-14)12-8(15)3-16-10(2)4-11-5-10/h11,13-14H,3-7H2,1-2H3,(H,12,15).
What are the key properties of N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide?
N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide has a molecular weight of 232.28 g/mol, XLogP of -1.78, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-(3-methylazetidin-3-yl)oxyacetamide is sourced from PubChem (CID 102656490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).