chempirical

M344

C16H25N3O3CAS 251456-60-7307.39 g/mol

Open in Covalent MOL file
NOHNOHNOH
AmideTertiary amine

Properties

Molecular formula
C16H25N3O3
Molar mass
307.39 g/mol
Exact mass
307.1896 Da
logP
1.94Crippen estimate
Polar surface area
81.7 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
9

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
251456-60-7
SMILES
CN(C)C1=CC=C(C=C1)C(=O)NCCCCCCC(=O)NO
InChIKey
MXWDSZWTBOCWBK-UHFFFAOYSA-N
InChI
InChI=1S/C16H25N3O3/c1-19(2)14-10-8-13(9-11-14)16(21)17-12-6-4-3-5-7-15(20)18-22/h8-11,22H,3-7,12H2,1-2H3,(H,17,21)(H,18,20)

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Names and synonyms

1 names
  • 4-(Dimethylamino)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide

Work with M344

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Acy-12151316214-52-458 % similar 4-(Dimethylamino)benzohydrazide19353-92-545 % similar 4-(Dimethylamino)benzoic acid619-84-138 % similar 4,4'-Bis(dimethylamino)benzophenone90-94-838 % similar 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide41859-57-836 % similar 4-Dimethylaminoacetophenone2124-31-436 % similar 4-(Dimethylamino)benzoyl chloride4755-50-436 % similar Poly(ethylene glycol) bis(p-dimethylaminobenzoate)71512-90-836 % similar

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

Elsewhere

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