sodium;carbamoyliminourea;hydride

C2H5N4NaO2 — CID 175072708

IUPACsodium;carbamoyliminourea;hydride
SMILESNC(=O)N=NC(N)=O.[H-].[Na+]
InChIInChI=1S/C2H4N4O2.Na.H/c3-1(7)5-6-2(4)8;;/h(H2,3,7)(H2,4,8);;/q;+1;-1
InChIKeyXXQSDRBGZKZJSW-UHFFFAOYSA-N
MW140.08 g/mol
LogP-3.29
Rot. Bonds

About sodium;carbamoyliminourea;hydride

sodium;carbamoyliminourea;hydride (PubChem CID 175072708) has the molecular formula C2H5N4NaO2 and a molecular weight of 140.08 g/mol. Its IUPAC name is sodium;carbamoyliminourea;hydride.

Molecular Properties

Compound Namesodium;carbamoyliminourea;hydride
PubChem CID175072708
Molecular FormulaC2H5N4NaO2
Molecular Weight140.08 g/mol
Exact Mass140.03
IUPAC Namesodium;carbamoyliminourea;hydride
SMILESNC(=O)N=NC(N)=O.[H-].[Na+]
InChIInChI=1S/C2H4N4O2.Na.H/c3-1(7)5-6-2(4)8;;/h(H2,3,7)(H2,4,8);;/q;+1;-1
InChIKeyXXQSDRBGZKZJSW-UHFFFAOYSA-N
XLogP-3.29
TPSA110.90 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.08
LogP ≤ 5-3.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

N-carbamoyliminoacetamide
CID 21045232
ethyl N-carbamoyliminocarbamate
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tert-butyliminourea
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2-(carbamoyldiazenyl)-2-methylpropanamide
CID 131231786
diamino(113C)methanone
CID 636363
sodium;hydride;sulfuric acid;urea
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disodium;carbamoyl carbamoperoxoate;hydride
CID 173126478
sodium;bis(carbamothioic S-acid);ethane;hydride
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sodium;urea;nitrite
CID 161284213
calcium;hydride;urea;hydrobromide
CID 173327121
calcium;hydride;urea;hydrate
CID 174880700
sodium;2-chloroacetamide;hydride
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Frequently Asked Questions

What is the IUPAC name of sodium;carbamoyliminourea;hydride?
The IUPAC name of sodium;carbamoyliminourea;hydride (CID 175072708) is sodium;carbamoyliminourea;hydride.
What is the SMILES notation for sodium;carbamoyliminourea;hydride?
The canonical SMILES for sodium;carbamoyliminourea;hydride is NC(=O)N=NC(N)=O.[H-].[Na+].
What is the InChIKey of sodium;carbamoyliminourea;hydride?
The InChIKey is XXQSDRBGZKZJSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4N4O2.Na.H/c3-1(7)5-6-2(4)8;;/h(H2,3,7)(H2,4,8);;/q;+1;-1.
What are the key properties of sodium;carbamoyliminourea;hydride?
sodium;carbamoyliminourea;hydride has a molecular weight of 140.08 g/mol, XLogP of -3.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;carbamoyliminourea;hydride is sourced from PubChem (CID 175072708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).