N-acetyl-N-methylbutanamide

C7H13NO2 — CID 142271883

IUPACN-acetyl-N-methylbutanamide
SMILESCCCC(=O)N(C)C(C)=O
InChIInChI=1S/C7H13NO2/c1-4-5-7(10)8(3)6(2)9/h4-5H2,1-3H3
InChIKeyULSYBIDMKNBMBK-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.79
Rot. Bonds2

About N-acetyl-N-methylbutanamide

N-acetyl-N-methylbutanamide (PubChem CID 142271883) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is N-acetyl-N-methylbutanamide.

Molecular Properties

Compound NameN-acetyl-N-methylbutanamide
PubChem CID142271883
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC NameN-acetyl-N-methylbutanamide
SMILESCCCC(=O)N(C)C(C)=O
InChIInChI=1S/C7H13NO2/c1-4-5-7(10)8(3)6(2)9/h4-5H2,1-3H3
InChIKeyULSYBIDMKNBMBK-UHFFFAOYSA-N
XLogP0.79
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-acetyl-N-methyltetradecanamide
CID 54508567
N-(dimethylcarbamoyl)-N-methylbutanamide
CID 178179553
N-acetyl-N-methylpropanamide;ethane
CID 143328121
1-[acetyl(diazonio)amino]-1-oxobutane
CID 56618970
N,N-dimethylbutanamide;hydrochloride
CID 87498306
N-acetyl-N,N'-dimethyl-N'-nonanoyloxamide
CID 54021759
CID 18739109
CID 18739109
N-ethoxy-N-methylacetamide
CID 23617223
N-acetyl-N,5-dimethylhexanamide
CID 122207721
N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide
CID 157213260
N,N-dibromobutanamide
CID 154147629
N-(aminomethyl)-N-methylbutanamide
CID 155070465

Frequently Asked Questions

What is the IUPAC name of N-acetyl-N-methylbutanamide?
The IUPAC name of N-acetyl-N-methylbutanamide (CID 142271883) is N-acetyl-N-methylbutanamide.
What is the SMILES notation for N-acetyl-N-methylbutanamide?
The canonical SMILES for N-acetyl-N-methylbutanamide is CCCC(=O)N(C)C(C)=O.
What is the InChIKey of N-acetyl-N-methylbutanamide?
The InChIKey is ULSYBIDMKNBMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-4-5-7(10)8(3)6(2)9/h4-5H2,1-3H3.
What are the key properties of N-acetyl-N-methylbutanamide?
N-acetyl-N-methylbutanamide has a molecular weight of 143.19 g/mol, XLogP of 0.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-N-methylbutanamide is sourced from PubChem (CID 142271883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).