4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine

C14H18N4O3 — CID 80867250

IUPAC4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine
SMILESCCCOc1ccccc1Oc1nc(NC)nc(OC)n1
InChIInChI=1S/C14H18N4O3/c1-4-9-20-10-7-5-6-8-11(10)21-14-17-12(15-2)16-13(18-14)19-3/h5-8H,4,9H2,1-3H3,(H,15,16,17,18)
InChIKeyXUHXVDRRMBQYMZ-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.50
Rot. Bonds7

About 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine

4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine (PubChem CID 80867250) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine
PubChem CID80867250
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine
SMILESCCCOc1ccccc1Oc1nc(NC)nc(OC)n1
InChIInChI=1S/C14H18N4O3/c1-4-9-20-10-7-5-6-8-11(10)21-14-17-12(15-2)16-13(18-14)19-3/h5-8H,4,9H2,1-3H3,(H,15,16,17,18)
InChIKeyXUHXVDRRMBQYMZ-UHFFFAOYSA-N
XLogP2.50
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80867540
4-(2-butan-2-ylphenoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80874064
4-(2,3-dimethylphenoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80864002
4-chloro-6-(2-ethoxyphenoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80863834
5-bromo-N-methyl-4-(2-propoxyphenoxy)pyrimidin-2-amine
CID 80862412
N-methyl-4-pentoxy-6-propoxy-1,3,5-triazin-2-amine
CID 80865211
4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80863784
6-methoxy-4-N-methyl-2-N-(4-propoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 80799796
4-methoxy-6-(3-methoxypropoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80866297
N-ethyl-4-methoxy-6-(2-propoxyphenyl)-1,3,5-triazin-2-amine
CID 104663162
4-methoxy-N-methyl-6-(4-propylphenoxy)-1,3,5-triazin-2-amine
CID 80878901
N-ethyl-4-methoxy-6-(6-propoxypyridazin-3-yl)oxy-1,3,5-triazin-2-amine
CID 2946464

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine (CID 80867250) is 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine is CCCOc1ccccc1Oc1nc(NC)nc(OC)n1.
What is the InChIKey of 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine?
The InChIKey is XUHXVDRRMBQYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-4-9-20-10-7-5-6-8-11(10)21-14-17-12(15-2)16-13(18-14)19-3/h5-8H,4,9H2,1-3H3,(H,15,16,17,18).
What are the key properties of 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine?
4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine has a molecular weight of 290.32 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80867250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).