1-(6-hydrazinylhexyl)pyrrole-2,5-dione

C10H17N3O2 — CID 90182839

IUPAC1-(6-hydrazinylhexyl)pyrrole-2,5-dione
SMILESNNCCCCCCN1C(=O)C=CC1=O
InChIInChI=1S/C10H17N3O2/c11-12-7-3-1-2-4-8-13-9(14)5-6-10(13)15/h5-6,12H,1-4,7-8,11H2
InChIKeyQZKAYPPFXQHSNR-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.06
Rot. Bonds7

About 1-(6-hydrazinylhexyl)pyrrole-2,5-dione

1-(6-hydrazinylhexyl)pyrrole-2,5-dione (PubChem CID 90182839) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-(6-hydrazinylhexyl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(6-hydrazinylhexyl)pyrrole-2,5-dione
PubChem CID90182839
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-(6-hydrazinylhexyl)pyrrole-2,5-dione
SMILESNNCCCCCCN1C(=O)C=CC1=O
InChIInChI=1S/C10H17N3O2/c11-12-7-3-1-2-4-8-13-9(14)5-6-10(13)15/h5-6,12H,1-4,7-8,11H2
InChIKeyQZKAYPPFXQHSNR-UHFFFAOYSA-N
XLogP-0.06
TPSA75.43 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 ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(6-aminohexyl)-2,5-dihydro-1H-pyrrole-2,5-dione hydrochloride
CID 23054408
E-Maleimidocaproic acid hydrazine hydrochloride
CID 44119987
6-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanehydrazide
CID 4170354
1H-Pyrrole-2,5-dione, 1-(5-aminopentyl)-
CID 10749944
1-(6-aminohexyl)-1H-pyrrole-2,5-dione
CID 23054403
11-Maleimidoundecanoic Acid Hydrazide
CID 4438236
1-[6-[(2,5-Dioxopyrrol-1-yl)amino]hexylamino]pyrrole-2,5-dione
CID 20209697
4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)butanehydrazide
CID 53249370
1-[6-(2-Diazohydrazinyl)hexyl]pyrrole-2,5-dione
CID 66739014
1-(3-Hydrazinylpropyl)pyrrole-2,5-dione
CID 66992825
1-(8-Aminooctyl)pyrrole-2,5-dione
CID 68004245
1-(Hexylamino)pyrrole-2,5-dione;hydrochloride
CID 68628926

Frequently Asked Questions

What is the IUPAC name of 1-(6-hydrazinylhexyl)pyrrole-2,5-dione?
The IUPAC name of 1-(6-hydrazinylhexyl)pyrrole-2,5-dione (CID 90182839) is 1-(6-hydrazinylhexyl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(6-hydrazinylhexyl)pyrrole-2,5-dione?
The canonical SMILES for 1-(6-hydrazinylhexyl)pyrrole-2,5-dione is NNCCCCCCN1C(=O)C=CC1=O.
What is the InChIKey of 1-(6-hydrazinylhexyl)pyrrole-2,5-dione?
The InChIKey is QZKAYPPFXQHSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c11-12-7-3-1-2-4-8-13-9(14)5-6-10(13)15/h5-6,12H,1-4,7-8,11H2.
What are the key properties of 1-(6-hydrazinylhexyl)pyrrole-2,5-dione?
1-(6-hydrazinylhexyl)pyrrole-2,5-dione has a molecular weight of 211.26 g/mol, XLogP of -0.06, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-hydrazinylhexyl)pyrrole-2,5-dione is sourced from PubChem (CID 90182839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).