N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane

C16H35NO4 — CID 172844761

IUPACN,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane
SMILESC=COOOCCCCCCCCCCCC.CN(C)O
InChIInChI=1S/C14H28O3.C2H7NO/c1-3-5-6-7-8-9-10-11-12-13-14-16-17-15-4-2;1-3(2)4/h4H,2-3,5-14H2,1H3;4H,1-2H3
InChIKeyXGPHLPVNOYYNBV-UHFFFAOYSA-N
MW305.46 g/mol
LogP4.87
Rot. Bonds14

About N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane

N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane (PubChem CID 172844761) has the molecular formula C16H35NO4 and a molecular weight of 305.46 g/mol. Its IUPAC name is N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane.

Molecular Properties

Compound NameN,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane
PubChem CID172844761
Molecular FormulaC16H35NO4
Molecular Weight305.46 g/mol
Exact Mass305.26
IUPAC NameN,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane
SMILESC=COOOCCCCCCCCCCCC.CN(C)O
InChIInChI=1S/C14H28O3.C2H7NO/c1-3-5-6-7-8-9-10-11-12-13-14-16-17-15-4-2;1-3(2)4/h4H,2-3,5-14H2,1H3;4H,1-2H3
InChIKeyXGPHLPVNOYYNBV-UHFFFAOYSA-N
XLogP4.87
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.46
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane?
The IUPAC name of N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane (CID 172844761) is N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane.
What is the SMILES notation for N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane?
The canonical SMILES for N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane is C=COOOCCCCCCCCCCCC.CN(C)O.
What is the InChIKey of N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane?
The InChIKey is XGPHLPVNOYYNBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3.C2H7NO/c1-3-5-6-7-8-9-10-11-12-13-14-16-17-15-4-2;1-3(2)4/h4H,2-3,5-14H2,1H3;4H,1-2H3.
What are the key properties of N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane?
N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane has a molecular weight of 305.46 g/mol, XLogP of 4.87, 14 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylhydroxylamine;1-ethenoxyperoxydodecane is sourced from PubChem (CID 172844761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).