N-[4-(1H-indazol-4-yl)phenyl]acetamide

C₁₅H₁₃N₃O — CID 146128615

About N-[4-(1H-indazol-4-yl)phenyl]acetamide

N-[4-(1H-indazol-4-yl)phenyl]acetamide (PubChem CID 146128615) has the molecular formula C₁₅H₁₃N₃O and a molecular weight of 251.29 g/mol. Its IUPAC name is N-[4-(1H-indazol-4-yl)phenyl]acetamide.

Molecular Properties

• Compound Name: N-[4-(1H-indazol-4-yl)phenyl]acetamide
• PubChem CID: 146128615
• Molecular Formula: C₁₅H₁₃N₃O
• Molecular Weight: 251.29 g/mol
• Exact Mass: 251.11
• IUPAC Name: N-[4-(1H-indazol-4-yl)phenyl]acetamide
• SMILES: CC(=O)Nc1ccc(-c2cccc3[nH]ncc23)cc1
• InChI: InChI=1S/C15H13N3O/c1-10(19)17-12-7-5-11(6-8-12)13-3-2-4-15-14(13)9-16-18-15/h2-9H,1H3,(H,16,18)(H,17,19)
• InChIKey: WLBSBJSRXJLVBL-UHFFFAOYSA-N
• XLogP: 3.19
• TPSA: 57.78 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 19
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	251.29
LogP ≤ 5	3.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-indazol-4-yl)phenyl]acetamide?

The IUPAC name of N-[4-(1H-indazol-4-yl)phenyl]acetamide (CID 146128615) is N-[4-(1H-indazol-4-yl)phenyl]acetamide.

What is the SMILES notation for N-[4-(1H-indazol-4-yl)phenyl]acetamide?

The canonical SMILES for N-[4-(1H-indazol-4-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2cccc3[nH]ncc23)cc1.

What is the InChIKey of N-[4-(1H-indazol-4-yl)phenyl]acetamide?

The InChIKey is WLBSBJSRXJLVBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-10(19)17-12-7-5-11(6-8-12)13-3-2-4-15-14(13)9-16-18-15/h2-9H,1H3,(H,16,18)(H,17,19).

What are the key properties of N-[4-(1H-indazol-4-yl)phenyl]acetamide?

N-[4-(1H-indazol-4-yl)phenyl]acetamide has a molecular weight of 251.29 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(1H-indazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 146128615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 146128615 — identifiers, structure, computed properties (public domain)

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