N-(2,2-dimethoxyethyl)-N-methylacetamide

C7H15NO3 — CID 3361052

IUPACN-(2,2-dimethoxyethyl)-N-methylacetamide
SMILESCOC(CN(C)C(C)=O)OC
InChIInChI=1S/C7H15NO3/c1-6(9)8(2)5-7(10-3)11-4/h7H,5H2,1-4H3
InChIKeyFHSAAWRYLYHAOD-UHFFFAOYSA-N
MW161.20 g/mol
LogP0.08
Rot. Bonds4

About N-(2,2-dimethoxyethyl)-N-methylacetamide

N-(2,2-dimethoxyethyl)-N-methylacetamide (PubChem CID 3361052) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is N-(2,2-dimethoxyethyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(2,2-dimethoxyethyl)-N-methylacetamide
PubChem CID3361052
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC NameN-(2,2-dimethoxyethyl)-N-methylacetamide
SMILESCOC(CN(C)C(C)=O)OC
InChIInChI=1S/C7H15NO3/c1-6(9)8(2)5-7(10-3)11-4/h7H,5H2,1-4H3
InChIKeyFHSAAWRYLYHAOD-UHFFFAOYSA-N
XLogP0.08
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethoxyethyl)-N-methylacetamide?
The IUPAC name of N-(2,2-dimethoxyethyl)-N-methylacetamide (CID 3361052) is N-(2,2-dimethoxyethyl)-N-methylacetamide.
What is the SMILES notation for N-(2,2-dimethoxyethyl)-N-methylacetamide?
The canonical SMILES for N-(2,2-dimethoxyethyl)-N-methylacetamide is COC(CN(C)C(C)=O)OC.
What is the InChIKey of N-(2,2-dimethoxyethyl)-N-methylacetamide?
The InChIKey is FHSAAWRYLYHAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-6(9)8(2)5-7(10-3)11-4/h7H,5H2,1-4H3.
What are the key properties of N-(2,2-dimethoxyethyl)-N-methylacetamide?
N-(2,2-dimethoxyethyl)-N-methylacetamide has a molecular weight of 161.20 g/mol, XLogP of 0.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethoxyethyl)-N-methylacetamide is sourced from PubChem (CID 3361052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).