sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide

C4H9N6NaO2 — CID 67590856

IUPACsodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide
SMILESC=O.Nc1nc(N)nc(N)n1.[Na+].[OH-]
InChIInChI=1S/C3H6N6.CH2O.Na.H2O/c4-1-7-2(5)9-3(6)8-1;1-2;;/h(H6,4,5,6,7,8,9);1H2;;1H2/q;;+1;/p-1
InChIKeyNCTAYTJWNPYTKR-UHFFFAOYSA-M
MW196.15 g/mol
LogP-4.74
Rot. Bonds

About sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide

sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide (PubChem CID 67590856) has the molecular formula C4H9N6NaO2 and a molecular weight of 196.15 g/mol. Its IUPAC name is sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide.

Molecular Properties

Compound Namesodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide
PubChem CID67590856
Molecular FormulaC4H9N6NaO2
Molecular Weight196.15 g/mol
Exact Mass196.07
IUPAC Namesodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide
SMILESC=O.Nc1nc(N)nc(N)n1.[Na+].[OH-]
InChIInChI=1S/C3H6N6.CH2O.Na.H2O/c4-1-7-2(5)9-3(6)8-1;1-2;;/h(H6,4,5,6,7,8,9);1H2;;1H2/q;;+1;/p-1
InChIKeyNCTAYTJWNPYTKR-UHFFFAOYSA-M
XLogP-4.74
TPSA163.80 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.15
LogP ≤ 5-4.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide?
The IUPAC name of sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide (CID 67590856) is sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide.
What is the SMILES notation for sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide?
The canonical SMILES for sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide is C=O.Nc1nc(N)nc(N)n1.[Na+].[OH-].
What is the InChIKey of sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide?
The InChIKey is NCTAYTJWNPYTKR-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H6N6.CH2O.Na.H2O/c4-1-7-2(5)9-3(6)8-1;1-2;;/h(H6,4,5,6,7,8,9);1H2;;1H2/q;;+1;/p-1.
What are the key properties of sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide?
sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide has a molecular weight of 196.15 g/mol, XLogP of -4.74, 0 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;formaldehyde;1,3,5-triazine-2,4,6-triamine;hydroxide is sourced from PubChem (CID 67590856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).