1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione

C10H17N3O2 — CID 121327293

IUPAC1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione
SMILESCCCNNCCCN1C(=O)C=CC1=O
InChIInChI=1S/C10H17N3O2/c1-2-6-11-12-7-3-8-13-9(14)4-5-10(13)15/h4-5,11-12H,2-3,6-8H2,1H3
InChIKeyMXTKZQNHFRYQNJ-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.19
Rot. Bonds7

About 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione

1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione (PubChem CID 121327293) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione.

Molecular Properties

Compound Name1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione
PubChem CID121327293
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione
SMILESCCCNNCCCN1C(=O)C=CC1=O
InChIInChI=1S/C10H17N3O2/c1-2-6-11-12-7-3-8-13-9(14)4-5-10(13)15/h4-5,11-12H,2-3,6-8H2,1H3
InChIKeyMXTKZQNHFRYQNJ-UHFFFAOYSA-N
XLogP-0.19
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-Maleimidopropionic acid hydrazide
CID 4401583
1-[3-(Ethylamino)propyl]pyrrole-2,5-dione
CID 12858660
1-[3-(4-Aminobutylamino)propylamino]pyrrole-2,5-dione
CID 18366521
N-ethylethanamine;1-propylpyrrole-2,5-dione
CID 20531811
1-[3-(Methylamino)propyl]pyrrole-2,5-dione
CID 20666020
3-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanehydrazide hydrochloride
CID 44119989
4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)butanehydrazide
CID 53249370
[3-(2,5-Dioxopyrrol-1-yl)propanoylamino]azanium
CID 59514921
1-(3-Hydrazinylpropyl)pyrrole-2,5-dione
CID 66992825
1,1-Dimethyl-2-propylhydrazine;pyrrole-2,5-dione
CID 67402743
N',N'-dimethylpropane-1,3-diamine;pyrrole-2,5-dione
CID 67402745
1-[3-(Dimethylamino)propylamino]pyrrole-2,5-dione
CID 68421398

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione?
The IUPAC name of 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione (CID 121327293) is 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione.
What is the SMILES notation for 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione?
The canonical SMILES for 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione is CCCNNCCCN1C(=O)C=CC1=O.
What is the InChIKey of 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione?
The InChIKey is MXTKZQNHFRYQNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-2-6-11-12-7-3-8-13-9(14)4-5-10(13)15/h4-5,11-12H,2-3,6-8H2,1H3.
What are the key properties of 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione?
1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione has a molecular weight of 211.26 g/mol, XLogP of -0.19, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-propylhydrazinyl)propyl]pyrrole-2,5-dione is sourced from PubChem (CID 121327293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).