Basic information
- CAS
119-48-2- Standard SMILES
CCCCN(CCN(CCCC)C(=O)N1CCOCC1)C(=O)N1CCOCC1- InChIKey
HZTMGWSBSDLALI-UHFFFAOYSA-N- Molecular formula
- C20H38N4O4
- Average molar mass
- 398.5 g/mol
- Monoisotopic mass
- 398.28930571
Overview
Dimorpholamine is a member of morpholines and a member of ureas.
Names & identifiers
- Preferred name
- Dimorpholamine
- IUPAC
- N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
- English name
- N,N'-ethylenebis(N-butylmorpholine-4-carboxamide)
- Molecular formula
- C20H38N4O4
- Molecular weight
- 398.54012
Names & synonyms
dimorpholamine119-48-2TheraptiqueDTXSID50576288YL4JT0L91N,N'-Ethylenebis(N-butylmorpholine-4-carboxamide)DTXCID6031417CHEBI:31501RefChem:134408204-328-7Dimorpholamine [JAN]N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
Show more names
Th-1064Respiron4-Morpholinecarboxamide, N,N'-1,2-ethanediylbis[N-butyl-
TheraleptiqueN,N'-(Ethane-1,2-diyl)bis(N-butylmorpholine-4-carboxamide)AtmurinProntodinAmipan TN-butyl-N-{2-[butyl(morpholine-4-carbonyl)amino]ethyl}morpholine-4-carboxamideEINECS 204-328-71064 TH
Database identifiers
- CAS
119-48-2- PubChem CID
- 3091
- DTXSID
DTXSID5057628- ChEMBL
CHEMBL2104294- ChEBI
CHEBI:31501- UNII
- 8YL4JT0L91
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 423
Physicochemical properties
- Melting point
- 41 · 41-42°
- Boiling point
- 0.4 · bp0.4 229°
- Density
- 1.1463 · 1.1463 (rough estimate)
- refractive index
- 1.662 · 1.6620 (estimate)
- pka
- -0.75 · -0.75±0.20(Predicted)
- FDA UNII
- 8 YL4JT0L91 · 8YL4JT0L91
- Toxicity
- 50 in · LD50 in mice (mg/10 g): 0.54 i.v.; 0.80 i.p.; 1.04 s.c.; 3.80 orally (Kasé)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 in mice (mg/10 g): 0.54 i.v.; 0.80 i.p.; 1.04 s.c.; 3.80 orally (Kasé)
Chemistry & industry
Suppliers3 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Additional notes
DefinitionChEBI: Dimorpholamine is a member of morpholines and a member of ureas.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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