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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H22N2O2.ClH
Molecular Weight 250.766
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of tert-Butyl 4-(aminomethyl)piperidine-1-carboxylate hydrochloride

SMILES

Cl.CC(C)(C)OC(=O)N1CCC(CN)CC1

InChI

InChIKey=DSXFEYYTYBXYMB-UHFFFAOYSA-N
InChI=1S/C11H22N2O2.ClH/c1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13;/h9H,4-8,12H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C11H22N2O2
Molecular Weight 214.3046
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:22:56 GMT 2023
Edited
by admin
on Sat Dec 16 20:22:56 GMT 2023
Record UNII
QYY4Q76SQB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
tert-Butyl 4-(aminomethyl)piperidine-1-carboxylate hydrochloride
Systematic Name English
1-Piperidinecarboxylic acid, 4-(aminomethyl)-, 1,1-dimethylethyl ester, hydrochloride (1:1)
Systematic Name English
1-tert-Butoxycarbonyl-4-aminomethylpiperidine hydrochloride
Systematic Name English
1-Boc-4-(aminomethyl)piperidine hydrochloride
Systematic Name English
Code System Code Type Description
PUBCHEM
2756034
Created by admin on Sat Dec 16 20:22:57 GMT 2023 , Edited by admin on Sat Dec 16 20:22:57 GMT 2023
PRIMARY
CAS
359629-16-6
Created by admin on Sat Dec 16 20:22:57 GMT 2023 , Edited by admin on Sat Dec 16 20:22:57 GMT 2023
PRIMARY
FDA UNII
QYY4Q76SQB
Created by admin on Sat Dec 16 20:22:57 GMT 2023 , Edited by admin on Sat Dec 16 20:22:57 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE