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

Details

Stereochemistry RACEMIC
Molecular Formula C7H16NO2.I
Molecular Weight 273.1119
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OXAPROPANIUM IODIDE

SMILES

[I-].C[N+](C)(C)CC1COCO1

InChI

InChIKey=HQWAEQCLIWVOMF-UHFFFAOYSA-M
InChI=1S/C7H16NO2.HI/c1-8(2,3)4-7-5-9-6-10-7;/h7H,4-6H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI
Molecular Formula C7H16NO2
Molecular Weight 146.2074
Charge 1
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity ( + / - )
Molecular Formula HI
Molecular Weight 127.91241
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Oxapropanium was studied as a cholinergic agent. Information about the current use of this compound is not available.

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:40:42 GMT 2025
Edited
by admin
on Mon Mar 31 18:40:42 GMT 2025
Record UNII
3F725G9N2A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DILVASENE
Preferred Name English
OXAPROPANIUM IODIDE
INN   MI  
INN  
Official Name English
(1,3-DIOXOLAN-4-YLMETHYL)TRIMETHYLAMMONIUM IODIDE
Systematic Name English
N,N,N-TRIMETHYL-1,3-DIOXOLANE-4-METHANAMINIUM IODIDE (1:1)
Systematic Name English
oxapropanium iodide [INN]
Common Name English
2249-F
Code English
AMMONIUM, (1,3-DIOXOLAN-4-YLMETHYL)TRIMETHYL-, IODIDE
Systematic Name English
OXAPROPANIUM IODIDE [MI]
Common Name English
1,3-DIOXOLANE-4-METHANAMINIUM, N,N,N-TRIMETHYL-, IODIDE (1:1)
Systematic Name English
TRIMETHYL(2,3-METHYLENEDIOXYPROPYL)AMMONIUM IODIDE
Systematic Name English
VASODILATATEUR-2249F
Code English
Classification Tree Code System Code
NCI_THESAURUS C66886
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
Code System Code Type Description
CAS
541-66-2
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
ChEMBL
CHEMBL2110650
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
INN
4162
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
SMS_ID
100000083031
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID20968971
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
FDA UNII
3F725G9N2A
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
EVMPD
SUB09500MIG
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
MERCK INDEX
m8292
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY Merck Index
PUBCHEM
10939
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
NCI_THESAURUS
C90897
Created by admin on Mon Mar 31 18:40:42 GMT 2025 , Edited by admin on Mon Mar 31 18:40:42 GMT 2025
PRIMARY
Related Record Type Details
Structure of OXAPROPANIUM IODIDE, (-)-
ENANTIOMER -> RACEMATE
Structure of OXAPROPANIUM IODIDE, (+)-
ENANTIOMER -> RACEMATE
Structure of OXAPROPANIUM
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of OXAPROPANIUM
ACTIVE MOIETY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966