U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H22N2O2
Molecular Weight 214.3046
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of tert-Butyl 3-(dimethylamino)pyrrolidine-1-carboxylate, (S)-

SMILES

CN(C)[C@H]1CCN(C1)C(=O)OC(C)(C)C

InChI

InChIKey=SOFNSBHMEVBTNR-VIFPVBQESA-N
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-7-6-9(8-13)12(4)5/h9H,6-8H2,1-5H3/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H22N2O2
Molecular Weight 214.3046
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:59:40 GMT 2025
Edited
by admin
on Wed Apr 02 20:59:40 GMT 2025
Record UNII
YFK2GF2RM9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
tert-Butyl 3-(dimethylamino)pyrrolidine-1-carboxylate, (S)-
Systematic Name English
(S)-1-Boc-3-Dimethylaminopyrrolidine
Preferred Name English
1,1-Dimethylethyl (3S)-3-(dimethylamino)-1-pyrrolidinecarboxylate
Systematic Name English
tert-Butyl (3S)-3-(dimethylamino)pyrrolidine-1-carboxylate
Systematic Name English
(S)-tert-Butyl 3-(dimethylamino)pyrrolidine-1-carboxylate
Systematic Name English
1-Pyrrolidinecarboxylic acid, 3-(dimethylamino)-, 1,1-dimethylethyl ester, (3S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
50999108
Created by admin on Wed Apr 02 20:59:40 GMT 2025 , Edited by admin on Wed Apr 02 20:59:40 GMT 2025
PRIMARY
CAS
1263077-95-7
Created by admin on Wed Apr 02 20:59:40 GMT 2025 , Edited by admin on Wed Apr 02 20:59:40 GMT 2025
PRIMARY
FDA UNII
YFK2GF2RM9
Created by admin on Wed Apr 02 20:59:40 GMT 2025 , Edited by admin on Wed Apr 02 20:59:40 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER