2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine

C5H10N6O2 — CID 11435367

IUPAC2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine
SMILESCON(OC)c1nc(N)nc(N)n1
InChIInChI=1S/C5H10N6O2/c1-12-11(13-2)5-9-3(6)8-4(7)10-5/h1-2H3,(H4,6,7,8,9,10)
InChIKeyQGADZRLWYNTVRO-UHFFFAOYSA-N
MW186.18 g/mol
LogP-1.03
Rot. Bonds3

About 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine

2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine (PubChem CID 11435367) has the molecular formula C5H10N6O2 and a molecular weight of 186.18 g/mol. Its IUPAC name is 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine
PubChem CID11435367
Molecular FormulaC5H10N6O2
Molecular Weight186.18 g/mol
Exact Mass186.09
IUPAC Name2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine
SMILESCON(OC)c1nc(N)nc(N)n1
InChIInChI=1S/C5H10N6O2/c1-12-11(13-2)5-9-3(6)8-4(7)10-5/h1-2H3,(H4,6,7,8,9,10)
InChIKeyQGADZRLWYNTVRO-UHFFFAOYSA-N
XLogP-1.03
TPSA112.41 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.18
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine (CID 11435367) is 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine is CON(OC)c1nc(N)nc(N)n1.
What is the InChIKey of 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine?
The InChIKey is QGADZRLWYNTVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N6O2/c1-12-11(13-2)5-9-3(6)8-4(7)10-5/h1-2H3,(H4,6,7,8,9,10).
What are the key properties of 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine?
2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine has a molecular weight of 186.18 g/mol, XLogP of -1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethoxy-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 11435367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).