N-acetyl-N-methylacetamide

C5H9NO2 — CID 14214

IUPACN-acetyl-N-methylacetamide
SMILESCC(=O)N(C)C(C)=O
InChIInChI=1S/C5H9NO2/c1-4(7)6(3)5(2)8/h1-3H3
InChIKeyZNQFZPCFVNOXJQ-UHFFFAOYSA-N
MW115.13 g/mol
LogP0.01
Rot. Bonds

About N-acetyl-N-methylacetamide

N-acetyl-N-methylacetamide (PubChem CID 14214) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is N-acetyl-N-methylacetamide.

Molecular Properties

Compound NameN-acetyl-N-methylacetamide
PubChem CID14214
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC NameN-acetyl-N-methylacetamide
SMILESCC(=O)N(C)C(C)=O
InChIInChI=1S/C5H9NO2/c1-4(7)6(3)5(2)8/h1-3H3
InChIKeyZNQFZPCFVNOXJQ-UHFFFAOYSA-N
XLogP0.01
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 50.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Dimethylacetamide
CID 31374
N,N-Diethylacetamide
CID 12703
N,N-Dimethylacetamide-d9
CID 22789542
N-Ethyl-N-methylacetamide
CID 13390905
N-Acetyl-N-ethylacetamide
CID 73808
N,N-Dimethyl(~13~C_2_)acetamide
CID 71308854
N,N,N-Triacetylamine
CID 136459
N,N-Dimethylacetamide--water (1/1)
CID 21534740
N-acetyl-N-methylcarbamoyl fluoride
CID 135060543
N-Acetyl-N-propylacetamide
CID 15280
N-Acetyl-N-(1-methylethyl)acetamide
CID 73809
Acetyl(trimethyl)azanium
CID 21378

Frequently Asked Questions

What is the IUPAC name of N-acetyl-N-methylacetamide?
The IUPAC name of N-acetyl-N-methylacetamide (CID 14214) is N-acetyl-N-methylacetamide.
What is the SMILES notation for N-acetyl-N-methylacetamide?
The canonical SMILES for N-acetyl-N-methylacetamide is CC(=O)N(C)C(C)=O.
What is the InChIKey of N-acetyl-N-methylacetamide?
The InChIKey is ZNQFZPCFVNOXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2/c1-4(7)6(3)5(2)8/h1-3H3.
What are the key properties of N-acetyl-N-methylacetamide?
N-acetyl-N-methylacetamide has a molecular weight of 115.13 g/mol, XLogP of 0.01, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-N-methylacetamide is sourced from PubChem (CID 14214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).