2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide

C18H19N3O — CID 20885372

IUPAC2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)Cn2ncc3ccccc32)cc1
InChIInChI=1S/C18H19N3O/c1-13(2)14-7-9-16(10-8-14)20-18(22)12-21-17-6-4-3-5-15(17)11-19-21/h3-11,13H,12H2,1-2H3,(H,20,22)
InChIKeyONAFZIMPOWJTBZ-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.80
Rot. Bonds4

About 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide

2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 20885372) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide
PubChem CID20885372
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)Cn2ncc3ccccc32)cc1
InChIInChI=1S/C18H19N3O/c1-13(2)14-7-9-16(10-8-14)20-18(22)12-21-17-6-4-3-5-15(17)11-19-21/h3-11,13H,12H2,1-2H3,(H,20,22)
InChIKeyONAFZIMPOWJTBZ-UHFFFAOYSA-N
XLogP3.80
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide (CID 20885372) is 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(NC(=O)Cn2ncc3ccccc32)cc1.
What is the InChIKey of 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is ONAFZIMPOWJTBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-13(2)14-7-9-16(10-8-14)20-18(22)12-21-17-6-4-3-5-15(17)11-19-21/h3-11,13H,12H2,1-2H3,(H,20,22).
What are the key properties of 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide?
2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 293.37 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indazol-1-yl-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 20885372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).