N-Alpha-(9-Fluorenylmethyloxycarbonyl)-L-prolinyl-L-proline

C25H26N2O5CAS 129223-22-9434.49 g/mol

Open in Covalent MOL file
NONOOOOH
AmideCarbamateCarboxylic acid

Properties

Molecular formula
C25H26N2O5
Molar mass
434.49 g/mol
Exact mass
434.1842 Da
logP
3.48Crippen estimate
Polar surface area
87.2 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
4
Stereocentres
S, Sin SMILES atom order

Hazards

Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
129223-22-9
SMILES
C1C[C@H](N(C1)C(=O)[C@@H]2CCCN2C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O
InChIKey
VRAQFWSWKRNOGU-VXKWHMMOSA-N
InChI
InChI=1S/C25H26N2O5/c28-23(26-13-6-12-22(26)24(29)30)21-11-5-14-27(21)25(31)32-15-20-18-9-3-1-7-16(18)17-8-2-4-10-19(17)20/h1-4,7-10,20-22H,5-6,11-15H2,(H,29,30)/t21-,22-/m0/s1

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Names and synonyms

1 names
  • Fmoc-pro-pro-oh

Work with N-Alpha-(9-Fluorenylmethyloxycarbonyl)-L-prolinyl-L-proline

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

(2R)-1-((9H-Fluoren-9-ylmethoxy)carbonyl)pyrrolidine-2-carboxylic acid101555-62-890 % similar Fmoc-pro-OH71989-31-690 % similar D-Fmoc-pipecolic acid101555-63-984 % similar 1-[(9H-Fluoren-9-ylmethoxy)carbonyl]piperidine-2-carboxylic acid105751-19-784 % similar Fmoc-L-pipecolic acid86069-86-584 % similar (S)-N-Fmoc-azetidine-2-carboxylic acid136552-06-278 % similar (4S)-1-Fmoc-4-methyl-L-proline1228577-03-463 % similar N-Fmoc-D-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid130309-33-063 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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