chempirical

Pentanamide

C5H11NOCAS 626-97-1101.15 g/mol

Open in Covalent MOL file
NH2O

Properties

Molecular formula
C5H11NO
Molar mass
101.15 g/mol
Exact mass
101.0841 Da
Density
0.8487 g/mL (at 20 °C)
Melting point
106 °C
Boiling point
225 °C
logP
1.71Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
3

Identifiers

CAS number
626-97-1
SMILES
CCCCC(=N)O
InChIKey
IPWFJLQDVFKJDU-UHFFFAOYSA-N
InChI
InChI=1S/C5H11NO/c1-2-3-4-5(6)7/h2-4H2,1H3,(H2,6,7)

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Type any one amount. The others follow from the molar mass and density.

Names and synonyms

5 names
  • Valeramide
  • n-Valeramide
  • Pentanimidic acid
  • Valeric acid amide
  • NSC 400223

Work with Pentanamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Hexanamide628-02-490 % similar Dodecanamide1120-16-786 % similar Stearamide124-26-586 % similar Behenamide3061-75-486 % similar Hexadecanamide629-54-986 % similar Tetradecanamide638-58-486 % similar Butyramide541-35-571 % similar Erucamide112-84-567 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(S)-(+)-1-Methyl-3-pyrrolidinol104641-59-0 (3R)-1-Methyl-3-pyrrolidinol104641-60-3 (3R)-Tetrahydro-3-furanmethanamine1048962-82-8 (3S)-Tetrahydro-3-furanmethanamine1048962-84-0 N-Methylmorpholine109-02-4 D-Beta-Prolinol110013-18-8 (3S)-3-Pyrrolidinemethanol110013-19-9 Oxan-3-amine120811-32-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook