1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one

C7H13N3O — CID 130490616

IUPAC1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one
SMILESNNC1CC(=O)N2CCCC12
InChIInChI=1S/C7H13N3O/c8-9-5-4-7(11)10-3-1-2-6(5)10/h5-6,9H,1-4,8H2
InChIKeyRBZPLRMKGPXZKE-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.79
Rot. Bonds1

About 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one

1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one (PubChem CID 130490616) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one.

Molecular Properties

Compound Name1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one
PubChem CID130490616
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one
SMILESNNC1CC(=O)N2CCCC12
InChIInChI=1S/C7H13N3O/c8-9-5-4-7(11)10-3-1-2-6(5)10/h5-6,9H,1-4,8H2
InChIKeyRBZPLRMKGPXZKE-UHFFFAOYSA-N
XLogP-0.79
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one?
The IUPAC name of 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one (CID 130490616) is 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one.
What is the SMILES notation for 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one?
The canonical SMILES for 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one is NNC1CC(=O)N2CCCC12.
What is the InChIKey of 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one?
The InChIKey is RBZPLRMKGPXZKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c8-9-5-4-7(11)10-3-1-2-6(5)10/h5-6,9H,1-4,8H2.
What are the key properties of 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one?
1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one has a molecular weight of 155.20 g/mol, XLogP of -0.79, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydrazinyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one is sourced from PubChem (CID 130490616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).