4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine

C14H18N4O2 — CID 80862836

IUPAC4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(Oc2ccc(C)cc2C)n1
InChIInChI=1S/C14H18N4O2/c1-4-7-19-13-16-12(15)17-14(18-13)20-11-6-5-9(2)8-10(11)3/h5-6,8H,4,7H2,1-3H3,(H2,15,16,17,18)
InChIKeyUCDBSNLHHCFZEW-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.65
Rot. Bonds5

About 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine

4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80862836) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80862836
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(Oc2ccc(C)cc2C)n1
InChIInChI=1S/C14H18N4O2/c1-4-7-19-13-16-12(15)17-14(18-13)20-11-6-5-9(2)8-10(11)3/h5-6,8H,4,7H2,1-3H3,(H2,15,16,17,18)
InChIKeyUCDBSNLHHCFZEW-UHFFFAOYSA-N
XLogP2.65
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-(2,5-dimethylphenyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80763432
4-(2-chloro-4-methylphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80878774
4-(2,4-dimethylphenoxy)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80866417
4-(3-bromophenoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80870082
4-ethoxy-6-(4-methylphenoxy)-1,3,5-triazin-2-amine
CID 80863450
2-N-[(3-methylphenyl)methyl]-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80790129
4-ethoxy-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,3,5-triazin-2-amine
CID 103176391
4-(3-bromo-5-fluorophenoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 81325572
4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80858156
4-[(3,5-dimethylphenyl)methylsulfanyl]-6-propoxy-1,3,5-triazin-2-amine
CID 80888591
6-(2,4-dimethylphenoxy)-5-propylpyrimidin-4-amine
CID 80862753
4-methyl-2-propoxyaniline
CID 24698653

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine (CID 80862836) is 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(N)nc(Oc2ccc(C)cc2C)n1.
What is the InChIKey of 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is UCDBSNLHHCFZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-4-7-19-13-16-12(15)17-14(18-13)20-11-6-5-9(2)8-10(11)3/h5-6,8H,4,7H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine?
4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 274.32 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylphenoxy)-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80862836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).