2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide

C15H12ClN3O2 — CID 17165269

IUPAC2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H12ClN3O2/c16-12-3-1-2-4-14(12)21-9-15(20)18-11-5-6-13-10(7-11)8-17-19-13/h1-8H,9H2,(H,17,19)(H,18,20)
InChIKeyGEPVKHTUVHXOOG-UHFFFAOYSA-N
MW301.73 g/mol
LogP3.23
Rot. Bonds4

About 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide

2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide (PubChem CID 17165269) has the molecular formula C15H12ClN3O2 and a molecular weight of 301.73 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide
PubChem CID17165269
Molecular FormulaC15H12ClN3O2
Molecular Weight301.73 g/mol
Exact Mass301.06
IUPAC Name2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H12ClN3O2/c16-12-3-1-2-4-14(12)21-9-15(20)18-11-5-6-13-10(7-11)8-17-19-13/h1-8H,9H2,(H,17,19)(H,18,20)
InChIKeyGEPVKHTUVHXOOG-UHFFFAOYSA-N
XLogP3.23
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.73
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide (CID 17165269) is 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide is O=C(COc1ccccc1Cl)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide?
The InChIKey is GEPVKHTUVHXOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2/c16-12-3-1-2-4-14(12)21-9-15(20)18-11-5-6-13-10(7-11)8-17-19-13/h1-8H,9H2,(H,17,19)(H,18,20).
What are the key properties of 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide?
2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide has a molecular weight of 301.73 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-(1H-indazol-5-yl)acetamide is sourced from PubChem (CID 17165269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).