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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H25N3
Molecular Weight 283.4112
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(ADAMANTAN-1-YL)-N'-(2-METHYLPHENYL)GUANIDINE

SMILES

CC1=CC=CC=C1NC(=N)NC23CC4CC(CC(C4)C2)C3

InChI

InChIKey=ORZBZECEAOIBIX-UHFFFAOYSA-N
InChI=1S/C18H25N3/c1-12-4-2-3-5-16(12)20-17(19)21-18-9-13-6-14(10-18)8-15(7-13)11-18/h2-5,13-15H,6-11H2,1H3,(H3,19,20,21)

HIDE SMILES / InChI

Molecular Formula C18H25N3
Molecular Weight 283.4112
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 13:41:16 GMT 2023
Edited
by admin
on Sat Dec 16 13:41:16 GMT 2023
Record UNII
I9DT08YNH7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(ADAMANTAN-1-YL)-N'-(2-METHYLPHENYL)GUANIDINE
Systematic Name English
GUANIDINE, N-(2-METHYLPHENYL)-N'-TRICYCLO(3.3.1.13,7)DEC-1-YL-
Systematic Name English
N-(2-METHYLPHENYL)-N'-TRICYCLO(3.3.1.13,7)DEC-1-YLGUANIDINE
Systematic Name English
Code System Code Type Description
CAS
124190-31-4
Created by admin on Sat Dec 16 13:41:16 GMT 2023 , Edited by admin on Sat Dec 16 13:41:16 GMT 2023
PRIMARY
PUBCHEM
14771696
Created by admin on Sat Dec 16 13:41:16 GMT 2023 , Edited by admin on Sat Dec 16 13:41:16 GMT 2023
PRIMARY
FDA UNII
I9DT08YNH7
Created by admin on Sat Dec 16 13:41:16 GMT 2023 , Edited by admin on Sat Dec 16 13:41:16 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY