N-formyl-N-methylacetamide

C4H7NO2 — CID 14417887

IUPACN-formyl-N-methylacetamide
SMILESCC(=O)N(C)C=O
InChIInChI=1S/C4H7NO2/c1-4(7)5(2)3-6/h3H,1-2H3
InChIKeyODGJIXXVIQDADK-UHFFFAOYSA-N
MW101.10 g/mol
LogP-0.38
Rot. Bonds1

About N-formyl-N-methylacetamide

N-formyl-N-methylacetamide (PubChem CID 14417887) has the molecular formula C4H7NO2 and a molecular weight of 101.10 g/mol. Its IUPAC name is N-formyl-N-methylacetamide.

Molecular Properties

Compound NameN-formyl-N-methylacetamide
PubChem CID14417887
Molecular FormulaC4H7NO2
Molecular Weight101.10 g/mol
Exact Mass101.05
IUPAC NameN-formyl-N-methylacetamide
SMILESCC(=O)N(C)C=O
InChIInChI=1S/C4H7NO2/c1-4(7)5(2)3-6/h3H,1-2H3
InChIKeyODGJIXXVIQDADK-UHFFFAOYSA-N
XLogP-0.38
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.10
LogP ≤ 5-0.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-Methyldiacetamide
CID 14214
N-acetyl-N-methylcarbamoyl fluoride
CID 135060543
N,N-diformylacetamide
CID 8063338
N-ethyl-N-formylformamide
CID 12540907
N-fluoro-N-formylacetamide
CID 173232529
N-ethyl-N-formylacetamide
CID 12885790
N-acetyl-N-formylacetamide
CID 14417886
Triacetyl(methyl)azanium
CID 16225507
Diacetyl(dimethyl)azanium
CID 19356901
N,N-dimethylacetamide;formaldehyde
CID 54040691
N,N-dimethylacetamide;N-formyl-N-methylformamide
CID 54486876
N-chloro-N-formylacetamide
CID 54573141

Frequently Asked Questions

What is the IUPAC name of N-formyl-N-methylacetamide?
The IUPAC name of N-formyl-N-methylacetamide (CID 14417887) is N-formyl-N-methylacetamide.
What is the SMILES notation for N-formyl-N-methylacetamide?
The canonical SMILES for N-formyl-N-methylacetamide is CC(=O)N(C)C=O.
What is the InChIKey of N-formyl-N-methylacetamide?
The InChIKey is ODGJIXXVIQDADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO2/c1-4(7)5(2)3-6/h3H,1-2H3.
What are the key properties of N-formyl-N-methylacetamide?
N-formyl-N-methylacetamide has a molecular weight of 101.10 g/mol, XLogP of -0.38, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-formyl-N-methylacetamide is sourced from PubChem (CID 14417887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).