2-(3-ethyl-2-methoxyphenyl)triazole

C11H13N3O — CID 134512729

IUPAC2-(3-ethyl-2-methoxyphenyl)triazole
SMILESCCc1cccc(-n2nccn2)c1OC
InChIInChI=1S/C11H13N3O/c1-3-9-5-4-6-10(11(9)15-2)14-12-7-8-13-14/h4-8H,3H2,1-2H3
InChIKeyGLPUCEFVMLIORP-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.84
Rot. Bonds3

About 2-(3-ethyl-2-methoxyphenyl)triazole

2-(3-ethyl-2-methoxyphenyl)triazole (PubChem CID 134512729) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 2-(3-ethyl-2-methoxyphenyl)triazole.

Molecular Properties

Compound Name2-(3-ethyl-2-methoxyphenyl)triazole
PubChem CID134512729
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name2-(3-ethyl-2-methoxyphenyl)triazole
SMILESCCc1cccc(-n2nccn2)c1OC
InChIInChI=1S/C11H13N3O/c1-3-9-5-4-6-10(11(9)15-2)14-12-7-8-13-14/h4-8H,3H2,1-2H3
InChIKeyGLPUCEFVMLIORP-UHFFFAOYSA-N
XLogP1.84
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(bromomethyl)-3-ethyl-2-methoxybenzene
CID 126971204
1-[2-(triazol-2-yl)phenyl]propan-1-one
CID 70794389
1-diphenylphosphoryl-3-ethyl-2-methoxybenzene
CID 11151842
3-ethyl-2-methoxy-6-pyrazol-1-ylbenzoic acid
CID 157483711
2-(3-ethyl-2-methoxyphenyl)propan-2-amine
CID 117284071
1-(3-ethyl-2-methoxyphenyl)ethanol
CID 84657475
2-(3-ethyl-2-methoxyphenyl)cyclohepta-2,4,6-trien-1-one
CID 118330551
ethane;1-ethyl-2-methoxy-3-propoxybenzene
CID 143988437
2-[2-(triazol-2-yl)phenyl]ethanamine
CID 82404989
2-(3-ethyl-2-methoxyphenyl)-5-fluoropyrimidine
CID 138713669
2-(3-ethyl-2-methoxyphenyl)-5-methylpyrazine
CID 167101555
1-ethyl-2-methoxy-3-(3-nitrosophenyl)benzene
CID 143170065

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-2-methoxyphenyl)triazole?
The IUPAC name of 2-(3-ethyl-2-methoxyphenyl)triazole (CID 134512729) is 2-(3-ethyl-2-methoxyphenyl)triazole.
What is the SMILES notation for 2-(3-ethyl-2-methoxyphenyl)triazole?
The canonical SMILES for 2-(3-ethyl-2-methoxyphenyl)triazole is CCc1cccc(-n2nccn2)c1OC.
What is the InChIKey of 2-(3-ethyl-2-methoxyphenyl)triazole?
The InChIKey is GLPUCEFVMLIORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-3-9-5-4-6-10(11(9)15-2)14-12-7-8-13-14/h4-8H,3H2,1-2H3.
What are the key properties of 2-(3-ethyl-2-methoxyphenyl)triazole?
2-(3-ethyl-2-methoxyphenyl)triazole has a molecular weight of 203.25 g/mol, XLogP of 1.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-2-methoxyphenyl)triazole is sourced from PubChem (CID 134512729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).