azanium;formaldehyde;urea;nitrate

C2H10N4O5 — CID 172716681

IUPACazanium;formaldehyde;urea;nitrate
SMILESC=O.NC(N)=O.O=[N+]([O-])[O-].[NH4+]
InChIInChI=1S/CH4N2O.CH2O.NO3.H3N/c2-1(3)4;1-2;2-1(3)4;/h(H4,2,3,4);1H2;;1H3/q;;-1;/p+1
InChIKeyFYLLEYXMOMXSGK-UHFFFAOYSA-O
MW170.13 g/mol
LogP-1.02
Rot. Bonds

About azanium;formaldehyde;urea;nitrate

azanium;formaldehyde;urea;nitrate (PubChem CID 172716681) has the molecular formula C2H10N4O5 and a molecular weight of 170.13 g/mol. Its IUPAC name is azanium;formaldehyde;urea;nitrate.

Molecular Properties

Compound Nameazanium;formaldehyde;urea;nitrate
PubChem CID172716681
Molecular FormulaC2H10N4O5
Molecular Weight170.13 g/mol
Exact Mass170.07
IUPAC Nameazanium;formaldehyde;urea;nitrate
SMILESC=O.NC(N)=O.O=[N+]([O-])[O-].[NH4+]
InChIInChI=1S/CH4N2O.CH2O.NO3.H3N/c2-1(3)4;1-2;2-1(3)4;/h(H4,2,3,4);1H2;;1H3/q;;-1;/p+1
InChIKeyFYLLEYXMOMXSGK-UHFFFAOYSA-O
XLogP-1.02
TPSA188.88 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.13
LogP ≤ 5-1.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

azanium;urea;nitrate
CID 10130003
azanium;urea;nitrate
CID 172844548
bis(nitric acid);urea
CID 163580845
calcium;potassium;hydride;urea;nitrate;dihydrate
CID 174993717
nitric acid;urea;hexahydrate
CID 175389070
dicalcium;urea;nitrate;nitrite
CID 161317819
formaldehyde;urea;hydrochloride
CID 158235523
azanium urea
CID 22635082
silver;acetamide;nitrate;hydrobromide
CID 174892203
sodium;but-2-enediamide;nitrate
CID 175419851
azanium;cerium;hydrogen peroxide;nitrate
CID 172815710
azanium;potassium;hydrogen carbonate;nitrate
CID 161270012

Frequently Asked Questions

What is the IUPAC name of azanium;formaldehyde;urea;nitrate?
The IUPAC name of azanium;formaldehyde;urea;nitrate (CID 172716681) is azanium;formaldehyde;urea;nitrate.
What is the SMILES notation for azanium;formaldehyde;urea;nitrate?
The canonical SMILES for azanium;formaldehyde;urea;nitrate is C=O.NC(N)=O.O=[N+]([O-])[O-].[NH4+].
What is the InChIKey of azanium;formaldehyde;urea;nitrate?
The InChIKey is FYLLEYXMOMXSGK-UHFFFAOYSA-O. The full InChI is InChI=1S/CH4N2O.CH2O.NO3.H3N/c2-1(3)4;1-2;2-1(3)4;/h(H4,2,3,4);1H2;;1H3/q;;-1;/p+1.
What are the key properties of azanium;formaldehyde;urea;nitrate?
azanium;formaldehyde;urea;nitrate has a molecular weight of 170.13 g/mol, XLogP of -1.02, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;formaldehyde;urea;nitrate is sourced from PubChem (CID 172716681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).