sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate

C5H20N2NaO4+ — CID 174873107

IUPACsodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate
SMILESC[N+](C)(C)C.N.O.O=C(O)O.[H-].[Na+]
InChIInChI=1S/C4H12N.CH2O3.H3N.Na.H2O.H/c1-5(2,3)4;2-1(3)4;;;;/h1-4H3;(H2,2,3,4);1H3;;1H2;/q+1;;;+1;;-1
InChIKeyQTLRUENJOZUQNW-UHFFFAOYSA-N
MW195.22 g/mol
LogP-3.00
Rot. Bonds

About sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate

sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate (PubChem CID 174873107) has the molecular formula C5H20N2NaO4+ and a molecular weight of 195.22 g/mol. Its IUPAC name is sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate.

Molecular Properties

Compound Namesodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate
PubChem CID174873107
Molecular FormulaC5H20N2NaO4+
Molecular Weight195.22 g/mol
Exact Mass195.13
IUPAC Namesodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate
SMILESC[N+](C)(C)C.N.O.O=C(O)O.[H-].[Na+]
InChIInChI=1S/C4H12N.CH2O3.H3N.Na.H2O.H/c1-5(2,3)4;2-1(3)4;;;;/h1-4H3;(H2,2,3,4);1H3;;1H2;/q+1;;;+1;;-1
InChIKeyQTLRUENJOZUQNW-UHFFFAOYSA-N
XLogP-3.00
TPSA124.03 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-3.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

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CID 174857583
sodium;azane;carbonic acid;copper;hydride
CID 175571937
sodium;carbonic acid;copper;hydride;hydrate
CID 173498577
sodium;carbonic acid;hydride
CID 173065911
trisodium;carbonic acid;hydride
CID 173012363
carbonic acid;hydrogen carbonate;tetramethylazanium
CID 175144739
sodium;azane;carbonic acid;hydride;molecular hydrogen
CID 174823294
hexasodium;acetic acid;azane;hydride
CID 173374702
magnesium;azane;carbonic acid;hydride;hydrate;hydrochloride
CID 174808719
magnesium;carbonic acid;hydride;trihydrate
CID 173024872
calcium;disodium;carbonic acid;hydride
CID 174940412
sodium;carbonic acid;hydride;hydrofluoride
CID 173386411

Frequently Asked Questions

What is the IUPAC name of sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate?
The IUPAC name of sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate (CID 174873107) is sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate.
What is the SMILES notation for sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate?
The canonical SMILES for sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate is C[N+](C)(C)C.N.O.O=C(O)O.[H-].[Na+].
What is the InChIKey of sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate?
The InChIKey is QTLRUENJOZUQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N.CH2O3.H3N.Na.H2O.H/c1-5(2,3)4;2-1(3)4;;;;/h1-4H3;(H2,2,3,4);1H3;;1H2;/q+1;;;+1;;-1.
What are the key properties of sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate?
sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate has a molecular weight of 195.22 g/mol, XLogP of -3.00, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;azane;carbonic acid;hydride;tetramethylazanium;hydrate is sourced from PubChem (CID 174873107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).