N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide

C11H22N2O3 — CID 158566943

IUPACN-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide
SMILESCC(=O)CN(C)C(C)=O.CCN(C)C(C)=O
InChIInChI=1S/C6H11NO2.C5H11NO/c1-5(8)4-7(3)6(2)9;1-4-6(3)5(2)7/h4H2,1-3H3;4H2,1-3H3
InChIKeyHRPHAIRTKINHBQ-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.54
Rot. Bonds3

About N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide

N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide (PubChem CID 158566943) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide
PubChem CID158566943
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC NameN-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide
SMILESCC(=O)CN(C)C(C)=O.CCN(C)C(C)=O
InChIInChI=1S/C6H11NO2.C5H11NO/c1-5(8)4-7(3)6(2)9;1-4-6(3)5(2)7/h4H2,1-3H3;4H2,1-3H3
InChIKeyHRPHAIRTKINHBQ-UHFFFAOYSA-N
XLogP0.54
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

butan-2-one;bis(N,N-dimethylethanamine);N-ethyl-N-methylacetamide
CID 159983542
ethane;1-[ethyl(methyl)amino]propan-2-one
CID 142250702
N-methyl-N-(2-methylprop-2-enyl)acetamide
CID 115968492
methyl 2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]acetate
CID 61383689
butan-2-one;N,N-dimethylmethanamine;ethane
CID 159619561
N-(3,3-dimethyl-2-oxobutyl)-N-methylacetamide
CID 58992304
butan-2-one;ethane;propane
CID 169173049
2-[[2-[acetyl(methyl)amino]acetyl]-methylamino]acetic acid
CID 43356271
3-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]propanoic acid
CID 61007980
2-[[2-[acetyl(methyl)amino]acetyl]-ethylamino]-2-methylpropanoic acid
CID 62818406
N-methyl-N-(3-oxobutyl)acetamide
CID 12830531
ethyl 2-[[2-[acetyl(methyl)amino]acetyl]-methylamino]acetate
CID 55207593

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide?
The IUPAC name of N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide (CID 158566943) is N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide.
What is the SMILES notation for N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide?
The canonical SMILES for N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide is CC(=O)CN(C)C(C)=O.CCN(C)C(C)=O.
What is the InChIKey of N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide?
The InChIKey is HRPHAIRTKINHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2.C5H11NO/c1-5(8)4-7(3)6(2)9;1-4-6(3)5(2)7/h4H2,1-3H3;4H2,1-3H3.
What are the key properties of N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide?
N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide has a molecular weight of 230.31 g/mol, XLogP of 0.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide is sourced from PubChem (CID 158566943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).