N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide

C18H19N3O2 — CID 48995254

IUPACN-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide
SMILESCCn1ncc2ccc(NC(=O)COc3ccccc3C)cc21
InChIInChI=1S/C18H19N3O2/c1-3-21-16-10-15(9-8-14(16)11-19-21)20-18(22)12-23-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,20,22)
InChIKeyFONABHMVFDFZGC-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.38
Rot. Bonds5

About N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide

N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide (PubChem CID 48995254) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide
PubChem CID48995254
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide
SMILESCCn1ncc2ccc(NC(=O)COc3ccccc3C)cc21
InChIInChI=1S/C18H19N3O2/c1-3-21-16-10-15(9-8-14(16)11-19-21)20-18(22)12-23-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,20,22)
InChIKeyFONABHMVFDFZGC-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-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide (CID 48995254) is N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide is CCn1ncc2ccc(NC(=O)COc3ccccc3C)cc21.
What is the InChIKey of N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
The InChIKey is FONABHMVFDFZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-21-16-10-15(9-8-14(16)11-19-21)20-18(22)12-23-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,20,22).
What are the key properties of N-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide?
N-(1-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-(1-ethylindazol-6-yl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 48995254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).