4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine

C11H12N4O3 — CID 80869201

IUPAC4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(Oc2ccccc2OC)n1
InChIInChI=1S/C11H12N4O3/c1-16-7-5-3-4-6-8(7)18-11-14-9(12)13-10(15-11)17-2/h3-6H,1-2H3,(H2,12,13,14,15)
InChIKeyMTASHHJXLYMJKC-UHFFFAOYSA-N
MW248.24 g/mol
LogP1.26
Rot. Bonds4

About 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine

4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine (PubChem CID 80869201) has the molecular formula C11H12N4O3 and a molecular weight of 248.24 g/mol. Its IUPAC name is 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine
PubChem CID80869201
Molecular FormulaC11H12N4O3
Molecular Weight248.24 g/mol
Exact Mass248.09
IUPAC Name4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(Oc2ccccc2OC)n1
InChIInChI=1S/C11H12N4O3/c1-16-7-5-3-4-6-8(7)18-11-14-9(12)13-10(15-11)17-2/h3-6H,1-2H3,(H2,12,13,14,15)
InChIKeyMTASHHJXLYMJKC-UHFFFAOYSA-N
XLogP1.26
TPSA92.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine (CID 80869201) is 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine is COc1nc(N)nc(Oc2ccccc2OC)n1.
What is the InChIKey of 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine?
The InChIKey is MTASHHJXLYMJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3/c1-16-7-5-3-4-6-8(7)18-11-14-9(12)13-10(15-11)17-2/h3-6H,1-2H3,(H2,12,13,14,15).
What are the key properties of 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine?
4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine has a molecular weight of 248.24 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(2-methoxyphenoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80869201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).