chempirical

Biphenyl-2-ylcarbamic acid piperidin-4-yl ester

C18H20N2O2CAS 171722-92-2296.37 g/mol

Open in Covalent MOL file
OHNONH
Secondary amine

Properties

Molecular formula
C18H20N2O2
Molar mass
296.37 g/mol
Exact mass
296.1525 Da
logP
3.67Crippen estimate
Polar surface area
53.9 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Identifiers

CAS number
171722-92-2
SMILES
OC(=Nc1ccccc1-c1ccccc1)OC1CCNCC1
InChIKey
AGZCCVMWUZINGV-UHFFFAOYSA-N
InChI
InChI=1S/C18H20N2O2/c21-18(22-15-10-12-19-13-11-15)20-17-9-5-4-8-16(17)14-6-2-1-3-7-14/h1-9,15,19H,10-13H2,(H,20,21)

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Names and synonyms

3 names
  • Carbamic acid, N-[1,1′-biphenyl]-2-yl-, 4-piperidinyl ester
  • Carbamic acid, [1,1′-biphenyl]-2-yl-, 4-piperidinyl ester
  • 4-Piperidyl N-(2-biphenylyl)carbamate

Work with Biphenyl-2-ylcarbamic acid piperidin-4-yl ester

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

1-[2-[[4-[[4-(Aminocarbonyl)-1-piperidinyl]methyl]benzoyl]methylamino]ethyl]-4-piperidinyl N-[1,1′-biphenyl]-2-ylcarbamate864750-70-942 % similar N-4-Piperidinylbenzamide33953-37-638 % similar Propham122-42-934 % similar 2-Biphenyl isocyanate17337-13-233 % similar 4-Phenylpiperidine771-99-333 % similar 4-(tert-Butoxycarbonylamino)piperidine73874-95-032 % similar Ethyl N-phenylcarbamate101-99-532 % similar [1,1′-Biphenyl]-2-methanol2928-43-032 % similar

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

Same formula

Ethyl 4-[[(ethylphenylamino)methylene]amino]benzoate65816-20-8

Elsewhere

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