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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H24N2O
Molecular Weight 236.3532
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-1496

SMILES

C[C@H](N)C1=CC=C(C=C1)[C@H](O)CNC(C)(C)C

InChI

InChIKey=KUHBBYPXWKYKKR-GXFFZTMASA-N
InChI=1S/C14H24N2O/c1-10(15)11-5-7-12(8-6-11)13(17)9-16-14(2,3)4/h5-8,10,13,16-17H,9,15H2,1-4H3/t10-,13+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MK-1496
Common Name English
BENZENEMETHANOL, 4-((1S)-1-AMINOETHYL)-.ALPHA.-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-, (.ALPHA.S)-
Systematic Name English
(1S)-1-(4-((1S)-1-AMINOETHYL)PHENYL)-2-(TERT-BUTYLAMINO)ETHANOL
Systematic Name English
Code System Code Type Description
FDA UNII
CS17H9370C
Created by admin on Sat Dec 16 10:20:20 GMT 2023 , Edited by admin on Sat Dec 16 10:20:20 GMT 2023
PRIMARY
CAS
1037254-47-9
Created by admin on Sat Dec 16 10:20:20 GMT 2023 , Edited by admin on Sat Dec 16 10:20:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID80697593
Created by admin on Sat Dec 16 10:20:20 GMT 2023 , Edited by admin on Sat Dec 16 10:20:20 GMT 2023
PRIMARY
PUBCHEM
67313626
Created by admin on Sat Dec 16 10:20:20 GMT 2023 , Edited by admin on Sat Dec 16 10:20:20 GMT 2023
PRIMARY
ChEMBL
CHEMBL3545077
Created by admin on Sat Dec 16 10:20:20 GMT 2023 , Edited by admin on Sat Dec 16 10:20:20 GMT 2023
PRIMARY
DRUG BANK
DB12763
Created by admin on Sat Dec 16 10:20:20 GMT 2023 , Edited by admin on Sat Dec 16 10:20:20 GMT 2023
PRIMARY