N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide

C17H17N3O2 — CID 155532506

IUPACN-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2nn(C)cc2c1
InChIInChI=1S/C17H17N3O2/c1-12-5-3-4-6-16(12)22-11-17(21)18-14-7-8-15-13(9-14)10-20(2)19-15/h3-10H,11H2,1-2H3,(H,18,21)
InChIKeyZCYPFWQQTWOGBG-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.90
Rot. Bonds4

About N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide

N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide (PubChem CID 155532506) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide
PubChem CID155532506
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC NameN-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2nn(C)cc2c1
InChIInChI=1S/C17H17N3O2/c1-12-5-3-4-6-16(12)22-11-17(21)18-14-7-8-15-13(9-14)10-20(2)19-15/h3-10H,11H2,1-2H3,(H,18,21)
InChIKeyZCYPFWQQTWOGBG-UHFFFAOYSA-N
XLogP2.90
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide (CID 155532506) is N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)Nc1ccc2nn(C)cc2c1.
What is the InChIKey of N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide?
The InChIKey is ZCYPFWQQTWOGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-12-5-3-4-6-16(12)22-11-17(21)18-14-7-8-15-13(9-14)10-20(2)19-15/h3-10H,11H2,1-2H3,(H,18,21).
What are the key properties of N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide?
N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide has a molecular weight of 295.34 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylindazol-5-yl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 155532506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).