chempirical

(D)-N-(Benzyloxycarbonyl)pipecolic acid

C14H17NO4CAS 28697-09-8263.29 g/mol

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NOOHOO
CarbamateCarboxylic acid

Properties

Molecular formula
C14H17NO4
Molar mass
263.29 g/mol
Exact mass
263.1158 Da
logP
2.26Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
28697-09-8
SMILES
C1CCN([C@H](C1)C(=O)O)C(=O)OCC2=CC=CC=C2
InChIKey
ZSAIHAKADPJIGN-GFCCVEGCSA-N
InChI
InChI=1S/C14H17NO4/c16-13(17)12-8-4-5-9-15(12)14(18)19-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,16,17)/t12-/m1/s1

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Names and synonyms

1 names
  • (2R)-1-((Benzyloxy)carbonyl)piperidine-2-carboxylic acid

Work with (D)-N-(Benzyloxycarbonyl)pipecolic acid

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1-Cbz-2-piperidinecarboxylic acid28697-07-6Stereo not defined

Similar compounds

Benzyloxycarbonyl-L-proline1148-11-493 % similar N-(Benzyloxycarbonyl)-D-proline6404-31-593 % similar (2S)-1-(Benzyloxycarbonyl)azetidine-2-carboxylic acid25654-52-883 % similar D-Fmoc-pipecolic acid101555-63-965 % similar 1-[(9H-Fluoren-9-ylmethoxy)carbonyl]piperidine-2-carboxylic acid105751-19-765 % similar (S)-1-N-Cbz-prolinamide34079-31-765 % similar 1-(Phenylmethyl) (2S,4R)-4-hydroxy-1,2-pyrrolidinedicarboxylate13504-85-362 % similar (2S,4S)-1-((Benzyloxy)carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid13504-86-462 % similar

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

Same formula

1-Carbobenzoxy-4-piperidinecarboxylic Acid10314-98-4

Elsewhere

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