Nicotinamide
Properties
- Molecular formula
- C6H6N2O
- Molar mass
- 122.13 g/mol
- Exact mass
- 122.0480 Da
- Density
- 1.4 g/mL (at 25 °C)
- Melting point
- 130 °C
- Boiling point
- 157 °C
- logP
- 0.96Crippen estimate
- Polar surface area
- 57.0 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Identifiers
CAS number
98-92-0SMILES
N=C(O)c1cccnc1InChIKey
DFPAKSUCGFBDDF-UHFFFAOYSA-NInChI
InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
41 names · show all
- Nicofort
- Niacinamide
- Nicamindon
- 3-Pyridinecarboxamide
- Aminicotin
- Benicot
- Delonin amide
- Dipegyl
- NAM
- Nicotilamide
- Nicotine acid amide
- Nicotinic acid amide
- Nicotinic amide
- Nicotylamide
- Niocinamide
- Niozymin
- Pelonin amide
- 3-Pyridinecarboxylic acid amide
- Vi-nicotyl
- Vitamin B3 (niacinamide)
- Vitamin B
- Nicosan 2
- 3-Carbamoylpyridine
- Pelmine
- β-Pyridinecarboxamide
- Nicobion
- Nicosylamide
- Nicovit
- Niavit PP
- Nicovitina
- Nicamina
- Nicasir
- 3-(Aminocarbonyl)pyridine
- m-(Aminocarbonyl)pyridine
- 3-Amidopyridine
- Papulex
- Nictoamide
- Pelmin
- NSC 13128
- NSC 27452
- Vitamin B3 (nicotinamide)
Work with Nicotinamide
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
Nicotinamide hydriodide3726-23-689 % similar
Benzamide55-21-056 % similar
Thionicotinamide4621-66-355 % similar
1,3-Benzenedicarboxamide1740-57-454 % similar
Nicotinyl methylamide114-33-050 % similar
Nicotinyl hydrazide553-53-750 % similar
3-Guanylpyridine hydrochloride7356-60-750 % similar
Nicotinanilide1752-96-149 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds