6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde

C7H13N3O — CID 176652903

IUPAC6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde
SMILESNNC1CC2(C1)CN(C=O)C2
InChIInChI=1S/C7H13N3O/c8-9-6-1-7(2-6)3-10(4-7)5-11/h5-6,9H,1-4,8H2
InChIKeyVOYOPSDXDXUPRZ-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.93
Rot. Bonds2

About 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde

6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde (PubChem CID 176652903) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde.

Molecular Properties

Compound Name6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde
PubChem CID176652903
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde
SMILESNNC1CC2(C1)CN(C=O)C2
InChIInChI=1S/C7H13N3O/c8-9-6-1-7(2-6)3-10(4-7)5-11/h5-6,9H,1-4,8H2
InChIKeyVOYOPSDXDXUPRZ-UHFFFAOYSA-N
XLogP-0.93
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde?
The IUPAC name of 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde (CID 176652903) is 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde.
What is the SMILES notation for 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde?
The canonical SMILES for 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde is NNC1CC2(C1)CN(C=O)C2.
What is the InChIKey of 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde?
The InChIKey is VOYOPSDXDXUPRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c8-9-6-1-7(2-6)3-10(4-7)5-11/h5-6,9H,1-4,8H2.
What are the key properties of 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde?
6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde has a molecular weight of 155.20 g/mol, XLogP of -0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-2-azaspiro[3.3]heptane-2-carbaldehyde is sourced from PubChem (CID 176652903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).