N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide

C25H57N5O6S — CID 54559321

IUPACN-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide
SMILESCCC(=O)NC.CCCC(=O)NC.CCCCC(=O)NC.CCCCCC(=O)NC.CCNS(C)(=O)=O
InChIInChI=1S/C7H15NO.C6H13NO.C5H11NO.C4H9NO.C3H9NO2S/c1-3-4-5-6-7(9)8-2;1-3-4-5-6(8)7-2;1-3-4-5(7)6-2;1-3-4(6)5-2;1-3-4-7(2,5)6/h3-6H2,1-2H3,(H,8,9);3-5H2,1-2H3,(H,7,8);3-4H2,1-2H3,(H,6,7);3H2,1-2H3,(H,5,6);4H,3H2,1-2H3
InChIKeyZPKQCGQMUJEQKK-UHFFFAOYSA-N
MW555.83 g/mol
LogP2.47
Rot. Bonds12

About N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide

N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide (PubChem CID 54559321) has the molecular formula C25H57N5O6S and a molecular weight of 555.83 g/mol. Its IUPAC name is N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide.

Molecular Properties

Compound NameN-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide
PubChem CID54559321
Molecular FormulaC25H57N5O6S
Molecular Weight555.83 g/mol
Exact Mass555.40
IUPAC NameN-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide
SMILESCCC(=O)NC.CCCC(=O)NC.CCCCC(=O)NC.CCCCCC(=O)NC.CCNS(C)(=O)=O
InChIInChI=1S/C7H15NO.C6H13NO.C5H11NO.C4H9NO.C3H9NO2S/c1-3-4-5-6-7(9)8-2;1-3-4-5-6(8)7-2;1-3-4-5(7)6-2;1-3-4(6)5-2;1-3-4-7(2,5)6/h3-6H2,1-2H3,(H,8,9);3-5H2,1-2H3,(H,7,8);3-4H2,1-2H3,(H,6,7);3H2,1-2H3,(H,5,6);4H,3H2,1-2H3
InChIKeyZPKQCGQMUJEQKK-UHFFFAOYSA-N
XLogP2.47
TPSA162.57 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500555.83
LogP ≤ 52.47
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-methylheptacosanamide
CID 18175889
N-methylnonadecanamide
CID 2724821
N-methylundecanamide
CID 23297450
ethane;N-methyltetradecanamide
CID 153349961
N-hydroxypropanamide;N-methylbutanamide
CID 158403694
1,2-dimethoxyethane;dimethoxymethane;N-ethylacetamide;N-ethylmethanesulfonamide;1-methoxybutane;1-methoxypropane;N-methylbutanamide;N-methylethanesulfonamide;N-methylpropanamide;N-methylpropane-1-sulfonamide;N-propylacetamide;N-propylmethanesulfonamide
CID 160997282
N-methylpropanamide;1-methylsulfonylpropane
CID 160744917
N,N'-dimethylheptanediamide
CID 15166696
ethane;N-methyl-6-(propanoylamino)hexanamide
CID 145098119
N,N-dimethylhexanamide;N-methylhexanamide
CID 90794993
N'-propanoylundecanehydrazide
CID 174995270
N-[2-(propanoylamino)ethyl]pentanamide
CID 108542545

Frequently Asked Questions

What is the IUPAC name of N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide?
The IUPAC name of N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide (CID 54559321) is N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide.
What is the SMILES notation for N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide?
The canonical SMILES for N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide is CCC(=O)NC.CCCC(=O)NC.CCCCC(=O)NC.CCCCCC(=O)NC.CCNS(C)(=O)=O.
What is the InChIKey of N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide?
The InChIKey is ZPKQCGQMUJEQKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C6H13NO.C5H11NO.C4H9NO.C3H9NO2S/c1-3-4-5-6-7(9)8-2;1-3-4-5-6(8)7-2;1-3-4-5(7)6-2;1-3-4(6)5-2;1-3-4-7(2,5)6/h3-6H2,1-2H3,(H,8,9);3-5H2,1-2H3,(H,7,8);3-4H2,1-2H3,(H,6,7);3H2,1-2H3,(H,5,6);4H,3H2,1-2H3.
What are the key properties of N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide?
N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide has a molecular weight of 555.83 g/mol, XLogP of 2.47, 12 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylmethanesulfonamide;N-methylbutanamide;N-methylhexanamide;N-methylpentanamide;N-methylpropanamide is sourced from PubChem (CID 54559321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).