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Succinimide, N-(4-(1-pyrrolidinyl)-2-butynyl)-

HCID 199231
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Basic information

CAS
3854-03-3
Standard SMILES
O=C1CCC(=O)N1CC#CCN1CCCC1
InChIKey
NWYYNQWZXOOUSH-UHFFFAOYSA-N
Molecular formula
C12H16N2O2
Average molar mass
220.27 g/mol
Monoisotopic mass
220.12117776

Names & identifiers

Preferred name
Succinimide, N-(4-(1-pyrrolidinyl)-2-butynyl)-
IUPAC
1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidine-2,5-dione
English name
N-[4-(1-Pyrrolidinyl)-2-butynyl]succinimide
Molecular formula
C12H16N2O2
Molecular weight
220.27

Names & synonyms

3854-03-3BRN 1533958Succinimide, N-(4-(1-pyrrolidinyl)-2-butynyl)-N-(4-Pyrrolidin-1'-ylbut-2-ynyl)succinimideDTXSID80191869RefChem:382454DTXCID70114360CHEMBL346737N-[4-(1-Pyrrolidinyl)-2-butynyl]succinimideN-[4-(1-pyrrolidinyl)-2-butynyl]-succinimideSCHEMBL11724860NWYYNQWZXOOUSH-UHFFFAOYSA-N
Show more names
2,5-Pyrrolidinedione, 1-[4-(1-pyrrolidinyl)-2-butyn-1-yl]-
1-[4-(PYRROLIDIN-1-YL)BUT-2-YN-1-YL]PYRROLIDINE-2,5-DIONEBDBM50227306N-(4-pyrrolidino-2-butynyl) succi-nimide

Database identifiers

CAS
3854-03-3
PubChem CID
199231
DTXSID
DTXSID80191869
ChEMBL
CHEMBL346737
Nikkaji
J90.604B

Properties

Computed structural properties

XLogP
-0.3
Topological polar surface area
40.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
342

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Related reactions

2 records
New reaction record
HRID 187660 reaction equation
HRID 187660As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 462078 reaction equation
HRID 462078As productuspto-grants-1977_12

Compound notes

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