CID 173051744

H4KN2O3 — CID 173051744

IUPAC—
SMILESN.O=[N+]([O-])O.[K]
InChIInChI=1S/K.HNO3.H3N/c;2-1(3)4;/h;(H,2,3,4);1H3
InChIKeyPZEUOOJSUDSZLA-UHFFFAOYSA-N
MW119.14 g/mol
LogP-0.57
Rot. Bonds

About CID 173051744

CID 173051744 (PubChem CID 173051744) has the molecular formula H4KN2O3 and a molecular weight of 119.14 g/mol.

Molecular Properties

Compound NameCID 173051744
PubChem CID173051744
Molecular FormulaH4KN2O3
Molecular Weight119.14 g/mol
Exact Mass118.99
IUPAC Name—
SMILESN.O=[N+]([O-])O.[K]
InChIInChI=1S/K.HNO3.H3N/c;2-1(3)4;/h;(H,2,3,4);1H3
InChIKeyPZEUOOJSUDSZLA-UHFFFAOYSA-N
XLogP-0.57
TPSA98.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

azane;tetrakis(nitric acid)
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azane;decakis(nitric acid)
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azane;(nitric acid)
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azane;bis(nitric acid);palladium
CID 6368740
azane;nitric acid;hydrochloride
CID 173035617
azane;nitric acid;rhodium
CID 173316947
azane;cobalt;nitric acid
CID 173271865
CID 172816736
CID 172816736
azane;nitric acid;palladium
CID 173303143
calcium;azane;bis(nitric acid);dinitrate
CID 173116154
azane;nitric acid;platinum;dihydrate
CID 173107458
azane;ethene;nitric acid
CID 175531507

Frequently Asked Questions

What is the IUPAC name of CID 173051744?
The IUPAC name of CID 173051744 (CID 173051744) is not available.
What is the SMILES notation for CID 173051744?
The canonical SMILES for CID 173051744 is N.O=[N+]([O-])O.[K].
What is the InChIKey of CID 173051744?
The InChIKey is PZEUOOJSUDSZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/K.HNO3.H3N/c;2-1(3)4;/h;(H,2,3,4);1H3.
What are the key properties of CID 173051744?
CID 173051744 has a molecular weight of 119.14 g/mol, XLogP of -0.57, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173051744 is sourced from PubChem (CID 173051744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).