Structure Database (LMSD)

Common Name
pentanamide
Systematic Name
pentanamide
Synonyms
LM ID
LMFA08010002
Status
Active
Exact Mass
Calculate m/z
101.084064
Formula



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MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
IPWFJLQDVFKJDU-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C5H11NO/c1-2-3-4-5(6)7/h2-4H2,1H3,(H2,6,7)
SMILES (Click to copy)
NC(=O)CCCC

References

Other Databases

KEGG ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 7
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 112.21
Topological Polar Surface Area 43.09
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 0.66
Molar Refractivity 28.72

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Created at
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Updated at
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