trans-1-Methyl-4-carboxy-5-(3-pyridyl)-2-pyrrolidinone
Properties
- Molecular formula
- C11H12N2O3
- Molar mass
- 220.23 g/mol
- Exact mass
- 220.0848 Da
- logP
- 0.69Crippen estimate
- Polar surface area
- 70.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
- Stereocentres
- S, Sin SMILES atom order
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
33224-01-0SMILES
CN1[C@@H]([C@H](CC1=O)C(=O)O)C2=CN=CC=C2InChIKey
DEYLVDCFTICBTB-WCBMZHEXSA-NInChI
InChI=1S/C11H12N2O3/c1-13-9(14)5-8(11(15)16)10(13)7-3-2-4-12-6-7/h2-4,6,8,10H,5H2,1H3,(H,15,16)/t8-,10+/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- rac-(2R,3R)-1-Methyl-5-oxo-2-(pyridin-3-yl)pyrrolidine-3-carboxylic acid
Work with trans-1-Methyl-4-carboxy-5-(3-pyridyl)-2-pyrrolidinone
Similar compounds
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L-3-Pyridylalanine64090-98-842 % similar
(αR)-α-Amino-3-pyridinepropanoic acid70702-47-542 % similar
cis-(1R,2S)-2-Phenylcyclopropane-1-carboxylic acid48126-51-837 % similar
trans-2-Phenylcyclopropanecarboxylic acid939-90-237 % similar
Boc-3-(3-pyridyl)-L-alanine117142-26-437 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds