CID 173438809

H9N7 — CID 173438809

IUPAC—
SMILESNN.NN.[N-]=[N+]=N
InChIInChI=1S/HN3.2H4N2/c1-3-2;2*1-2/h1H;2*1-2H2
InChIKeyYJEAXHWTSXVIDJ-UHFFFAOYSA-N
MW107.12 g/mol
LogP-1.49
Rot. Bonds

About CID 173438809

CID 173438809 (PubChem CID 173438809) has the molecular formula H9N7 and a molecular weight of 107.12 g/mol.

Molecular Properties

Compound NameCID 173438809
PubChem CID173438809
Molecular FormulaH9N7
Molecular Weight107.12 g/mol
Exact Mass107.09
IUPAC Name—
SMILESNN.NN.[N-]=[N+]=N
InChIInChI=1S/HN3.2H4N2/c1-3-2;2*1-2/h1H;2*1-2H2
InChIKeyYJEAXHWTSXVIDJ-UHFFFAOYSA-N
XLogP-1.49
TPSA164.33 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.12
LogP ≤ 5-1.49
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'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 CID 173438809?
The IUPAC name of CID 173438809 (CID 173438809) is not available.
What is the SMILES notation for CID 173438809?
The canonical SMILES for CID 173438809 is NN.NN.[N-]=[N+]=N.
What is the InChIKey of CID 173438809?
The InChIKey is YJEAXHWTSXVIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/HN3.2H4N2/c1-3-2;2*1-2/h1H;2*1-2H2.
What are the key properties of CID 173438809?
CID 173438809 has a molecular weight of 107.12 g/mol, XLogP of -1.49, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173438809 is sourced from PubChem (CID 173438809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).