N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide

C18H19N3O2 — CID 155519116

IUPACN-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide
SMILESCCn1cc2ccc(NC(=O)COc3ccccc3C)cc2n1
InChIInChI=1S/C18H19N3O2/c1-3-21-11-14-8-9-15(10-16(14)20-21)19-18(22)12-23-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,19,22)
InChIKeyZAIYJGQQIMSRAE-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.38
Rot. Bonds5

About N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide

N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide (PubChem CID 155519116) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide
PubChem CID155519116
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide
SMILESCCn1cc2ccc(NC(=O)COc3ccccc3C)cc2n1
InChIInChI=1S/C18H19N3O2/c1-3-21-11-14-8-9-15(10-16(14)20-21)19-18(22)12-23-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,19,22)
InChIKeyZAIYJGQQIMSRAE-UHFFFAOYSA-N
XLogP3.38
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide (CID 155519116) is N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide is CCn1cc2ccc(NC(=O)COc3ccccc3C)cc2n1.
What is the InChIKey of N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
The InChIKey is ZAIYJGQQIMSRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-21-11-14-8-9-15(10-16(14)20-21)19-18(22)12-23-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,19,22).
What are the key properties of N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide has a molecular weight of 309.37 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 155519116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).