Carbamic acid, ethyl-, (2-(2-(((ethylamino)carbonyl)oxy)ethyl)-2,5-dihydro-1-methyl-1H-pyrrol-3-yl)methyl ester
Basic information
- CAS
68384-66-7- Standard SMILES
CCNC(=O)OCCC1C(COC(=O)NCC)=CCN1C- InChIKey
NDGRGJFGBCEGFN-UHFFFAOYSA-N- Molecular formula
- C14H25N3O4
- Average molar mass
- 299.37 g/mol
- Monoisotopic mass
- 299.18450629
Names & identifiers
- Preferred name
- Carbamic acid, ethyl-, (2-(2-(((ethylamino)carbonyl)oxy)ethyl)-2,5-dihydro-1-methyl-1H-pyrrol-3-yl)methyl ester
- IUPAC
- 2-[3-(ethylcarbamoyloxymethyl)-1-methyl-2,5-dihydropyrrol-2-yl]ethyl N-ethylcarbamate
Names & synonyms
68384-66-7Carbamic acid, ethyl-, (2-(2-(((ethylamino)carbonyl)oxy)ethyl)-2,5-dihydro-1-methyl-1H-pyrrol-3-yl)methyl esterRefChem:1080905BRN 1493024Synthanecine D bis-N-ethylcarbamate2,5-Dihydro-3-(hydroxymethyl)-1-methyl-1H-pyrrole-2-ethanol bis(ethylcarbamate)3-Pyrroline-2-ethanol, 3-(hydroxymethyl)-1-methyl-, bis(ethylcarbamate)1H-Pyrrole-2-ethanol, 2,5-dihydro-3-(hydroxymethyl)-1-methyl-, bis(ethylcarbamate)DTXSID60987929(2-{2-[(Ethylimino)(hydroxy)methoxy]ethyl}-1-methyl-2,5-dihydro-1H-pyrrol-3-yl)methyl hydrogen ethylcarbonimidate
Database identifiers
- CAS
68384-66-7- PubChem CID
- 50162
- DTXSID
DTXSID60987929
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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