tert-Butyl 2-(4-(pyridin-2-yl)benzyl)hydrazinecarboxylate

C₁₇H₂₁N₃O₂CAS 198904-85-7299.37 g/mol

Open in Covalent MOL file

Carbamate Secondary amine

Properties

Molecular formula: C₁₇H₂₁N₃O₂
Molar mass: 299.37 g/mol
Exact mass: 299.1634 Da
logP: 3.28Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 4

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

198904-85-7

SMILES

CC(C)(C)OC(=O)NNCC1=CC=C(C=C1)C2=CC=CC=N2

InChIKey

GIMJTKJSKPENNG-UHFFFAOYSA-N

InChI

InChI=1S/C17H21N3O2/c1-17(2,3)22-16(21)20-19-12-13-7-9-14(10-8-13)15-6-4-5-11-18-15/h4-11,19H,12H2,1-3H3,(H,20,21)

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Work with tert-Butyl 2-(4-(pyridin-2-yl)benzyl)hydrazinecarboxylate

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

2-(Boc-amino)pyridine38427-94-050 % similar 1,1-Dimethylethyl 2-[[4-(2-pyridinyl)phenyl]methylene]hydrazinecarboxylate198904-84-646 % similar tert-Butyl N-(benzyloxy)carbamate79722-21-744 % similar 1-(N-Boc-aminomethyl)-4-(aminomethyl)benzene108468-00-443 % similar Boc-3-(2-pyridyl)-Ala-OH71239-85-543 % similar 2-(N-Boc-Amino)-3-methylpyridine138343-75-642 % similar Lcz696 intemediate1426129-50-142 % similar 4-[(tert-Butoxycarbonylamino)methyl]benzoic acid33233-67-941 % similar

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

Elsewhere

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