phenanthridin-6-ylmethylhydrazine

C14H13N3 — CID 16774020

IUPACphenanthridin-6-ylmethylhydrazine
SMILESNNCc1nc2ccccc2c2ccccc12
InChIInChI=1S/C14H13N3/c15-16-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)17-14/h1-8,16H,9,15H2
InChIKeyIXVOXMWSPLMNFM-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.35
Rot. Bonds2

About phenanthridin-6-ylmethylhydrazine

phenanthridin-6-ylmethylhydrazine (PubChem CID 16774020) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is phenanthridin-6-ylmethylhydrazine.

Molecular Properties

Compound Namephenanthridin-6-ylmethylhydrazine
PubChem CID16774020
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Namephenanthridin-6-ylmethylhydrazine
SMILESNNCc1nc2ccccc2c2ccccc12
InChIInChI=1S/C14H13N3/c15-16-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)17-14/h1-8,16H,9,15H2
InChIKeyIXVOXMWSPLMNFM-UHFFFAOYSA-N
XLogP2.35
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.35
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-ylmethylhydrazine?
The IUPAC name of phenanthridin-6-ylmethylhydrazine (CID 16774020) is phenanthridin-6-ylmethylhydrazine.
What is the SMILES notation for phenanthridin-6-ylmethylhydrazine?
The canonical SMILES for phenanthridin-6-ylmethylhydrazine is NNCc1nc2ccccc2c2ccccc12.
What is the InChIKey of phenanthridin-6-ylmethylhydrazine?
The InChIKey is IXVOXMWSPLMNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c15-16-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)17-14/h1-8,16H,9,15H2.
What are the key properties of phenanthridin-6-ylmethylhydrazine?
phenanthridin-6-ylmethylhydrazine has a molecular weight of 223.28 g/mol, XLogP of 2.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenanthridin-6-ylmethylhydrazine is sourced from PubChem (CID 16774020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).