acetamide;N-methylacetamide

C5H12N2O2 — CID 22906249

IUPACacetamide;N-methylacetamide
SMILESCC(N)=O.CNC(C)=O
InChIInChI=1S/C3H7NO.C2H5NO/c1-3(5)4-2;1-2(3)4/h1-2H3,(H,4,5);1H3,(H2,3,4)
InChIKeySZYMPBOGVCHDEH-UHFFFAOYSA-N
MW132.16 g/mol
LogP-0.76
Rot. Bonds

About acetamide;N-methylacetamide

acetamide;N-methylacetamide (PubChem CID 22906249) has the molecular formula C5H12N2O2 and a molecular weight of 132.16 g/mol. Its IUPAC name is acetamide;N-methylacetamide.

Molecular Properties

Compound Nameacetamide;N-methylacetamide
PubChem CID22906249
Molecular FormulaC5H12N2O2
Molecular Weight132.16 g/mol
Exact Mass132.09
IUPAC Nameacetamide;N-methylacetamide
SMILESCC(N)=O.CNC(C)=O
InChIInChI=1S/C3H7NO.C2H5NO/c1-3(5)4-2;1-2(3)4/h1-2H3,(H,4,5);1H3,(H2,3,4)
InChIKeySZYMPBOGVCHDEH-UHFFFAOYSA-N
XLogP-0.76
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of acetamide;N-methylacetamide?
The IUPAC name of acetamide;N-methylacetamide (CID 22906249) is acetamide;N-methylacetamide.
What is the SMILES notation for acetamide;N-methylacetamide?
The canonical SMILES for acetamide;N-methylacetamide is CC(N)=O.CNC(C)=O.
What is the InChIKey of acetamide;N-methylacetamide?
The InChIKey is SZYMPBOGVCHDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.C2H5NO/c1-3(5)4-2;1-2(3)4/h1-2H3,(H,4,5);1H3,(H2,3,4).
What are the key properties of acetamide;N-methylacetamide?
acetamide;N-methylacetamide has a molecular weight of 132.16 g/mol, XLogP of -0.76, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;N-methylacetamide is sourced from PubChem (CID 22906249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).