phenanthridin-6-ylhydrazine

C13H11N3 — CID 5130352

IUPACphenanthridin-6-ylhydrazine
SMILESNNc1nc2ccccc2c2ccccc12
InChIInChI=1S/C13H11N3/c14-16-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)15-13/h1-8H,14H2,(H,15,16)
InChIKeyVODJTROQLRJXHY-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.67
Rot. Bonds1

About phenanthridin-6-ylhydrazine

phenanthridin-6-ylhydrazine (PubChem CID 5130352) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is phenanthridin-6-ylhydrazine.

Molecular Properties

Compound Namephenanthridin-6-ylhydrazine
PubChem CID5130352
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC Namephenanthridin-6-ylhydrazine
SMILESNNc1nc2ccccc2c2ccccc12
InChIInChI=1S/C13H11N3/c14-16-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)15-13/h1-8H,14H2,(H,15,16)
InChIKeyVODJTROQLRJXHY-UHFFFAOYSA-N
XLogP2.67
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.67
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'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of phenanthridin-6-ylhydrazine?
The IUPAC name of phenanthridin-6-ylhydrazine (CID 5130352) is phenanthridin-6-ylhydrazine.
What is the SMILES notation for phenanthridin-6-ylhydrazine?
The canonical SMILES for phenanthridin-6-ylhydrazine is NNc1nc2ccccc2c2ccccc12.
What is the InChIKey of phenanthridin-6-ylhydrazine?
The InChIKey is VODJTROQLRJXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c14-16-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)15-13/h1-8H,14H2,(H,15,16).
What are the key properties of phenanthridin-6-ylhydrazine?
phenanthridin-6-ylhydrazine has a molecular weight of 209.25 g/mol, XLogP of 2.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenanthridin-6-ylhydrazine is sourced from PubChem (CID 5130352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).