2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide

C15H11ClFN3O2 — CID 17165399

IUPAC2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide
SMILESO=C(COc1ccc(F)cc1Cl)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H11ClFN3O2/c16-12-6-10(17)1-4-14(12)22-8-15(21)19-11-2-3-13-9(5-11)7-18-20-13/h1-7H,8H2,(H,18,20)(H,19,21)
InChIKeyHLYNJPPKEXGAAB-UHFFFAOYSA-N
MW319.72 g/mol
LogP3.37
Rot. Bonds4

About 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide

2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide (PubChem CID 17165399) has the molecular formula C15H11ClFN3O2 and a molecular weight of 319.72 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide
PubChem CID17165399
Molecular FormulaC15H11ClFN3O2
Molecular Weight319.72 g/mol
Exact Mass319.05
IUPAC Name2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide
SMILESO=C(COc1ccc(F)cc1Cl)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H11ClFN3O2/c16-12-6-10(17)1-4-14(12)22-8-15(21)19-11-2-3-13-9(5-11)7-18-20-13/h1-7H,8H2,(H,18,20)(H,19,21)
InChIKeyHLYNJPPKEXGAAB-UHFFFAOYSA-N
XLogP3.37
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.72
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide?
The IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide (CID 17165399) is 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide is O=C(COc1ccc(F)cc1Cl)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide?
The InChIKey is HLYNJPPKEXGAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN3O2/c16-12-6-10(17)1-4-14(12)22-8-15(21)19-11-2-3-13-9(5-11)7-18-20-13/h1-7H,8H2,(H,18,20)(H,19,21).
What are the key properties of 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide?
2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide has a molecular weight of 319.72 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenoxy)-N-(1H-indazol-5-yl)acetamide is sourced from PubChem (CID 17165399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).