4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine

C10H20N6O2 — CID 142654905

IUPAC4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine
SMILESCON(C)c1nc(N)nc(N(C)OCC(C)C)n1
InChIInChI=1S/C10H20N6O2/c1-7(2)6-18-16(4)10-13-8(11)12-9(14-10)15(3)17-5/h7H,6H2,1-5H3,(H2,11,12,13,14)
InChIKeyNQGZZJQEXFFLQE-UHFFFAOYSA-N
MW256.31 g/mol
LogP0.48
Rot. Bonds6

About 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine

4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine (PubChem CID 142654905) has the molecular formula C10H20N6O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine
PubChem CID142654905
Molecular FormulaC10H20N6O2
Molecular Weight256.31 g/mol
Exact Mass256.16
IUPAC Name4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine
SMILESCON(C)c1nc(N)nc(N(C)OCC(C)C)n1
InChIInChI=1S/C10H20N6O2/c1-7(2)6-18-16(4)10-13-8(11)12-9(14-10)15(3)17-5/h7H,6H2,1-5H3,(H2,11,12,13,14)
InChIKeyNQGZZJQEXFFLQE-UHFFFAOYSA-N
XLogP0.48
TPSA89.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

2-N-methoxy-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine
CID 21183458
2-N,2-N-dimethyl-6-[2-(2-methylpropoxy)ethoxy]-1,3,5-triazine-2,4-diamine
CID 106451415
2-N-[methoxy(2-methylpropoxy)methyl]-1,3,5-triazine-2,4,6-triamine
CID 70477811
2-N-(4,6-diamino-1,3,5-triazin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 144607170
2-N,4-N,4-N-trimethyl-2-N-(4-methylpentan-2-yl)-1,3,5-triazine-2,4,6-triamine
CID 80810743
4-[(dimethylamino)methoxy]-6-(2-methylpropoxy)pyrimidine-2,5-diamine
CID 118167296
6-ethoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80810648
6-butan-2-yloxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80866087
2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 80774603
2-N,2-N,4-N,4-N,6-N,6-N-hexakis[methoxy(2-methylpropoxy)methyl]-1,3,5-triazine-2,4,6-triamine
CID 54547524
2-N,2-N-bis(2-methoxyethyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80795772
[2,5-diamino-6-(2-methylpropoxy)pyrimidin-4-yl] N,N-dimethylcarbamate
CID 118188213

Frequently Asked Questions

What is the IUPAC name of 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine (CID 142654905) is 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine is CON(C)c1nc(N)nc(N(C)OCC(C)C)n1.
What is the InChIKey of 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is NQGZZJQEXFFLQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N6O2/c1-7(2)6-18-16(4)10-13-8(11)12-9(14-10)15(3)17-5/h7H,6H2,1-5H3,(H2,11,12,13,14).
What are the key properties of 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine?
4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 256.31 g/mol, XLogP of 0.48, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-methoxy-2-N,4-N-dimethyl-2-N-(2-methylpropoxy)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 142654905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).