CID 57423931

HIN4 — CID 57423931

IUPAC—
SMILES[N-]=[N+]=NNI
InChIInChI=1S/HIN4/c1-3-5-4-2/h3H
InChIKeyKVVXPRGHUYWFPD-UHFFFAOYSA-N
MW183.94 g/mol
LogP1.15
Rot. Bonds1

About CID 57423931

CID 57423931 (PubChem CID 57423931) has the molecular formula HIN4 and a molecular weight of 183.94 g/mol.

Molecular Properties

Compound NameCID 57423931
PubChem CID57423931
Molecular FormulaHIN4
Molecular Weight183.94 g/mol
Exact Mass183.92
IUPAC Name—
SMILES[N-]=[N+]=NNI
InChIInChI=1S/HIN4/c1-3-5-4-2/h3H
InChIKeyKVVXPRGHUYWFPD-UHFFFAOYSA-N
XLogP1.15
TPSA60.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.94
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

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2-(2-diazohydrazinyl)-3-sulfanylpropanoic acid
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azido-λ2-plumbane;copper
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1-azidoazetidin-2-one
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Frequently Asked Questions

What is the IUPAC name of CID 57423931?
The IUPAC name of CID 57423931 (CID 57423931) is not available.
What is the SMILES notation for CID 57423931?
The canonical SMILES for CID 57423931 is [N-]=[N+]=NNI.
What is the InChIKey of CID 57423931?
The InChIKey is KVVXPRGHUYWFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/HIN4/c1-3-5-4-2/h3H.
What are the key properties of CID 57423931?
CID 57423931 has a molecular weight of 183.94 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57423931 is sourced from PubChem (CID 57423931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).