4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine

C15H20N4O2 — CID 80874080

IUPAC4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine
SMILESCCOc1nc(N)nc(Oc2ccccc2C(C)CC)n1
InChIInChI=1S/C15H20N4O2/c1-4-10(3)11-8-6-7-9-12(11)21-15-18-13(16)17-14(19-15)20-5-2/h6-10H,4-5H2,1-3H3,(H2,16,17,18,19)
InChIKeyDWGGBBORDYBTQQ-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.16
Rot. Bonds6

About 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine

4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine (PubChem CID 80874080) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine
PubChem CID80874080
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine
SMILESCCOc1nc(N)nc(Oc2ccccc2C(C)CC)n1
InChIInChI=1S/C15H20N4O2/c1-4-10(3)11-8-6-7-9-12(11)21-15-18-13(16)17-14(19-15)20-5-2/h6-10H,4-5H2,1-3H3,(H2,16,17,18,19)
InChIKeyDWGGBBORDYBTQQ-UHFFFAOYSA-N
XLogP3.16
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2-butan-2-ylphenoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80874064
6-(2-butan-2-ylphenoxy)-2,5-dimethylpyrimidin-4-amine
CID 80881297
4-ethoxy-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,3,5-triazin-2-amine
CID 103176391
4-ethoxy-6-(4-methoxyphenoxy)-1,3,5-triazin-2-amine
CID 80870272
6-(2-butan-2-ylphenoxy)-2-ethylpyrimidin-4-amine
CID 80941065
4-butan-2-yloxy-6-ethoxy-1,3,5-triazin-2-amine
CID 80867376
4-(2-butan-2-ylphenoxy)butan-2-amine
CID 43118978
4-(4-chlorophenoxy)-6-ethoxy-1,3,5-triazin-2-amine
CID 80863734
4-ethoxy-6-(4-methylphenoxy)-1,3,5-triazin-2-amine
CID 80863450
[4-(2-butan-2-ylphenoxy)pyrimidin-2-yl]hydrazine
CID 80916193
6-[(2-butan-2-ylphenoxy)methyl]pyridin-2-amine
CID 79239022
5-amino-6-(2-butan-2-ylphenoxy)pyridine-2-carboxylic acid
CID 114408523

Frequently Asked Questions

What is the IUPAC name of 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine (CID 80874080) is 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine is CCOc1nc(N)nc(Oc2ccccc2C(C)CC)n1.
What is the InChIKey of 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine?
The InChIKey is DWGGBBORDYBTQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-10(3)11-8-6-7-9-12(11)21-15-18-13(16)17-14(19-15)20-5-2/h6-10H,4-5H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine?
4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine has a molecular weight of 288.35 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-butan-2-ylphenoxy)-6-ethoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80874080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).