acetamide;tetramethylazanium

C6H17N2O+ — CID 87267382

IUPACacetamide;tetramethylazanium
SMILESCC(N)=O.C[N+](C)(C)C
InChIInChI=1S/C4H12N.C2H5NO/c1-5(2,3)4;1-2(3)4/h1-4H3;1H3,(H2,3,4)/q+1;
InChIKeyKXUYHNUGUAJJJX-UHFFFAOYSA-N
MW133.21 g/mol
LogP-0.19
Rot. Bonds

About acetamide;tetramethylazanium

acetamide;tetramethylazanium (PubChem CID 87267382) has the molecular formula C6H17N2O+ and a molecular weight of 133.21 g/mol. Its IUPAC name is acetamide;tetramethylazanium.

Molecular Properties

Compound Nameacetamide;tetramethylazanium
PubChem CID87267382
Molecular FormulaC6H17N2O+
Molecular Weight133.21 g/mol
Exact Mass133.13
IUPAC Nameacetamide;tetramethylazanium
SMILESCC(N)=O.C[N+](C)(C)C
InChIInChI=1S/C4H12N.C2H5NO/c1-5(2,3)4;1-2(3)4/h1-4H3;1H3,(H2,3,4)/q+1;
InChIKeyKXUYHNUGUAJJJX-UHFFFAOYSA-N
XLogP-0.19
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.21
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze acetamide;tetramethylazanium 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 acetamide;tetramethylazanium?
The IUPAC name of acetamide;tetramethylazanium (CID 87267382) is acetamide;tetramethylazanium.
What is the SMILES notation for acetamide;tetramethylazanium?
The canonical SMILES for acetamide;tetramethylazanium is CC(N)=O.C[N+](C)(C)C.
What is the InChIKey of acetamide;tetramethylazanium?
The InChIKey is KXUYHNUGUAJJJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N.C2H5NO/c1-5(2,3)4;1-2(3)4/h1-4H3;1H3,(H2,3,4)/q+1;.
What are the key properties of acetamide;tetramethylazanium?
acetamide;tetramethylazanium has a molecular weight of 133.21 g/mol, XLogP of -0.19, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;tetramethylazanium is sourced from PubChem (CID 87267382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).