4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine

C14H18N4O3 — CID 80867540

IUPAC4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NC)nc(Oc2ccccc2OC)n1
InChIInChI=1S/C14H18N4O3/c1-4-9-20-13-16-12(15-2)17-14(18-13)21-11-8-6-5-7-10(11)19-3/h5-8H,4,9H2,1-3H3,(H,15,16,17,18)
InChIKeyKQFRUVIQGZEURV-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.50
Rot. Bonds7

About 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine

4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80867540) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80867540
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NC)nc(Oc2ccccc2OC)n1
InChIInChI=1S/C14H18N4O3/c1-4-9-20-13-16-12(15-2)17-14(18-13)21-11-8-6-5-7-10(11)19-3/h5-8H,4,9H2,1-3H3,(H,15,16,17,18)
InChIKeyKQFRUVIQGZEURV-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-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine
CID 80867250
N-methyl-4-pentoxy-6-propoxy-1,3,5-triazin-2-amine
CID 80865211
4-(2-chloro-4-methylphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80878774
4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80863784
4-(3,4-dichlorophenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80874024
2-N-(4-methoxyphenyl)-4-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80758431
N-methyl-4-phenylsulfanyl-6-propoxy-1,3,5-triazin-2-amine
CID 80887454
4-chloro-6-(2-ethoxyphenoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80863834
4-(2-butan-2-ylphenoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80874064
2-N,4-N-dimethyl-2-N-(2-methylphenyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80795742
4-methoxy-6-(3-methoxypropoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80866297
4-N-methyl-2-N-(2-phenylethyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80772443

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine (CID 80867540) is 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(NC)nc(Oc2ccccc2OC)n1.
What is the InChIKey of 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is KQFRUVIQGZEURV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-4-9-20-13-16-12(15-2)17-14(18-13)21-11-8-6-5-7-10(11)19-3/h5-8H,4,9H2,1-3H3,(H,15,16,17,18).
What are the key properties of 4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine?
4-(2-methoxyphenoxy)-N-methyl-6-propoxy-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-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80867540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).