N-methyl-N-(2-oxoethyl)acetamide

C5H9NO2 — CID 15885752

IUPACN-methyl-N-(2-oxoethyl)acetamide
SMILESCC(=O)N(C)CC=O
InChIInChI=1S/C5H9NO2/c1-5(8)6(2)3-4-7/h4H,3H2,1-2H3
InChIKeyBZLWCXGFPPXARR-UHFFFAOYSA-N
MW115.13 g/mol
LogP-0.34
Rot. Bonds2

About N-methyl-N-(2-oxoethyl)acetamide

N-methyl-N-(2-oxoethyl)acetamide (PubChem CID 15885752) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is N-methyl-N-(2-oxoethyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(2-oxoethyl)acetamide
PubChem CID15885752
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC NameN-methyl-N-(2-oxoethyl)acetamide
SMILESCC(=O)N(C)CC=O
InChIInChI=1S/C5H9NO2/c1-5(8)6(2)3-4-7/h4H,3H2,1-2H3
InChIKeyBZLWCXGFPPXARR-UHFFFAOYSA-N
XLogP-0.34
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.34
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,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide
CID 174398754
ethane;N-methyl-N-(3-oxopropyl)acetamide
CID 143162499
ethyl N-methyl-N-(2-oxoethyl)carbamate
CID 126971639
N-ethyl-N-(2-oxoethyl)acetamide
CID 23525604
N-methyl-N-pentadec-2-enylacetamide
CID 123664370
2-cyclopentyl-N-methyl-N-(2-oxoethyl)acetamide
CID 88582522
(E)-4-bromo-N-methyl-N-(2-oxoethyl)but-2-enamide
CID 170592880
N-(2,2-dimethyl-3-oxopropyl)-N-methylacetamide
CID 15555425
N-(2-oxoethyl)-N-prop-2-enylacetamide
CID 19738524
N-methyl-2-(methylamino)-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]acetamide
CID 176959929
N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide
CID 54420661
N-butyl-N-methylacetamide;ethane
CID 142088805

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-oxoethyl)acetamide?
The IUPAC name of N-methyl-N-(2-oxoethyl)acetamide (CID 15885752) is N-methyl-N-(2-oxoethyl)acetamide.
What is the SMILES notation for N-methyl-N-(2-oxoethyl)acetamide?
The canonical SMILES for N-methyl-N-(2-oxoethyl)acetamide is CC(=O)N(C)CC=O.
What is the InChIKey of N-methyl-N-(2-oxoethyl)acetamide?
The InChIKey is BZLWCXGFPPXARR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2/c1-5(8)6(2)3-4-7/h4H,3H2,1-2H3.
What are the key properties of N-methyl-N-(2-oxoethyl)acetamide?
N-methyl-N-(2-oxoethyl)acetamide has a molecular weight of 115.13 g/mol, XLogP of -0.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-oxoethyl)acetamide is sourced from PubChem (CID 15885752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).