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

C13H15N3O2 — CID 107713663

IUPAC2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol
SMILESCc1nnc(Oc2ccccc2CCO)nc1C
InChIInChI=1S/C13H15N3O2/c1-9-10(2)15-16-13(14-9)18-12-6-4-3-5-11(12)7-8-17/h3-6,17H,7-8H2,1-2H3
InChIKeyOHLDNLQEZGHCFL-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.82
Rot. Bonds4

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

2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol (PubChem CID 107713663) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol.

Molecular Properties

Compound Name2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol
PubChem CID107713663
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol
SMILESCc1nnc(Oc2ccccc2CCO)nc1C
InChIInChI=1S/C13H15N3O2/c1-9-10(2)15-16-13(14-9)18-12-6-4-3-5-11(12)7-8-17/h3-6,17H,7-8H2,1-2H3
InChIKeyOHLDNLQEZGHCFL-UHFFFAOYSA-N
XLogP1.82
TPSA68.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol with MolForge

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Related Compounds

2-[2-[(4-chloro-6-propan-2-yloxy-1,3,5-triazin-2-yl)oxy]phenyl]ethanol
CID 107712359
2-[2-(2-amino-4-methylphenoxy)phenyl]ethanol
CID 70462198
N'-hydroxy-2-[2-(2-hydroxyethyl)phenoxy]-6-methylpyridine-3-carboximidamide
CID 107712563
2-[2-[(5-amino-3-bromo-4-methyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107712102
[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]-6-fluorophenyl]methanamine
CID 114787502
3-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]pyridine-2-carboxylic acid
CID 114787467
2-[2-[(3-bromo-5-methyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107713700
2-[2-[2-(aminomethyl)-4-methylphenoxy]phenyl]ethanol
CID 107926570
2-[2-(2-hydroxyethyl)phenoxy]-4-methylbenzenecarbothioamide
CID 107712493
2-[2-(2-hydroxyethyl)phenoxy]-4-methylbenzamide
CID 107713704
2-[2-[2-[(propan-2-ylamino)methyl]phenoxy]phenyl]ethanol
CID 107712955
2-[2-(6-chloro-2-cyclopropyl-5-methylpyrimidin-4-yl)oxyphenyl]ethanol
CID 107712328

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
The IUPAC name of 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol (CID 107713663) is 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol.
What is the SMILES notation for 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
The canonical SMILES for 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol is Cc1nnc(Oc2ccccc2CCO)nc1C.
What is the InChIKey of 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
The InChIKey is OHLDNLQEZGHCFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-10(2)15-16-13(14-9)18-12-6-4-3-5-11(12)7-8-17/h3-6,17H,7-8H2,1-2H3.
What are the key properties of 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol?
2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol has a molecular weight of 245.28 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)oxy]phenyl]ethanol is sourced from PubChem (CID 107713663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).