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

C10H17N3O2 — CID 102656133

IUPACN-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(C#N)CNC(=O)COC1(C)CNC1
InChIInChI=1S/C10H17N3O2/c1-8(3-11)4-13-9(14)5-15-10(2)6-12-7-10/h8,12H,4-7H2,1-2H3,(H,13,14)
InChIKeyCDQDBLKNJZDNDD-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.36
Rot. Bonds5

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

N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide (PubChem CID 102656133) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
PubChem CID102656133
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCC(C#N)CNC(=O)COC1(C)CNC1
InChIInChI=1S/C10H17N3O2/c1-8(3-11)4-13-9(14)5-15-10(2)6-12-7-10/h8,12H,4-7H2,1-2H3,(H,13,14)
InChIKeyCDQDBLKNJZDNDD-UHFFFAOYSA-N
XLogP-0.36
TPSA74.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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-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-(3-methylazetidin-3-yl)oxy-N-[(2-methylcyclopropyl)methyl]acetamide
CID 102611285
2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]ethyl carbamate
CID 102656535

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The IUPAC name of N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide (CID 102656133) is N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide.
What is the SMILES notation for N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The canonical SMILES for N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide is CC(C#N)CNC(=O)COC1(C)CNC1.
What is the InChIKey of N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
The InChIKey is CDQDBLKNJZDNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-8(3-11)4-13-9(14)5-15-10(2)6-12-7-10/h8,12H,4-7H2,1-2H3,(H,13,14).
What are the key properties of N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide?
N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide has a molecular weight of 211.26 g/mol, XLogP of -0.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanopropyl)-2-(3-methylazetidin-3-yl)oxyacetamide is sourced from PubChem (CID 102656133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).