2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol

C15H19N3O2 — CID 106544706

IUPAC2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol
SMILESCCc1nnc(Oc2ccc(CCO)cc2)nc1CC
InChIInChI=1S/C15H19N3O2/c1-3-13-14(4-2)17-18-15(16-13)20-12-7-5-11(6-8-12)9-10-19/h5-8,19H,3-4,9-10H2,1-2H3
InChIKeyIYNVQFJPMJNLOM-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.32
Rot. Bonds6

About 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol

2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol (PubChem CID 106544706) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol
PubChem CID106544706
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol
SMILESCCc1nnc(Oc2ccc(CCO)cc2)nc1CC
InChIInChI=1S/C15H19N3O2/c1-3-13-14(4-2)17-18-15(16-13)20-12-7-5-11(6-8-12)9-10-19/h5-8,19H,3-4,9-10H2,1-2H3
InChIKeyIYNVQFJPMJNLOM-UHFFFAOYSA-N
XLogP2.32
TPSA68.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(5-iodopyrimidin-2-yl)oxyphenyl]ethanol
CID 104844198
2-[4-[5-(hydroxymethyl)-4-methylpyrimidin-2-yl]oxyphenyl]ethanol
CID 107709771
2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol
CID 107710167
5,6-diethyl-3-(3-iodophenoxy)-1,2,4-triazine
CID 105362314
2-[4-(3-ethyl-1-methyl-4-nitropyrazol-5-yl)oxyphenyl]ethanol
CID 107709674
2-[4-(2-hydroxyethyl)phenoxy]-6-methylpyrimidine-4-carboxylic acid
CID 107710034
2-[4-(2-hydroxyethyl)phenoxy]-4-methylpyrimidine-5-carboxylic acid
CID 107708674
2-(4-trimethylsilyloxyphenyl)ethanol
CID 167738071
2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol
CID 103844538
2-[4-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]oxy]phenyl]ethanol
CID 107710379
2-[4-[6-(hydroxymethyl)pyridazin-3-yl]oxyphenyl]ethanol
CID 107709782
2-[4-(5-chloro-2-methoxypyrimidin-4-yl)oxyphenyl]ethanol
CID 107709676

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
The IUPAC name of 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol (CID 106544706) is 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
The canonical SMILES for 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol is CCc1nnc(Oc2ccc(CCO)cc2)nc1CC.
What is the InChIKey of 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
The InChIKey is IYNVQFJPMJNLOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-13-14(4-2)17-18-15(16-13)20-12-7-5-11(6-8-12)9-10-19/h5-8,19H,3-4,9-10H2,1-2H3.
What are the key properties of 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol has a molecular weight of 273.34 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol is sourced from PubChem (CID 106544706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).