N-(1-phenylpyrazol-3-yl)acetamide

C11H11N3O — CID 594242

IUPACN-(1-phenylpyrazol-3-yl)acetamide
SMILESCC(=O)Nc1ccn(-c2ccccc2)n1
InChIInChI=1S/C11H11N3O/c1-9(15)12-11-7-8-14(13-11)10-5-3-2-4-6-10/h2-8H,1H3,(H,12,13,15)
InChIKeyAJAGRYDBLGRURH-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.83
Rot. Bonds2

About N-(1-phenylpyrazol-3-yl)acetamide

N-(1-phenylpyrazol-3-yl)acetamide (PubChem CID 594242) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is N-(1-phenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-phenylpyrazol-3-yl)acetamide
PubChem CID594242
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC NameN-(1-phenylpyrazol-3-yl)acetamide
SMILESCC(=O)Nc1ccn(-c2ccccc2)n1
InChIInChI=1S/C11H11N3O/c1-9(15)12-11-7-8-14(13-11)10-5-3-2-4-6-10/h2-8H,1H3,(H,12,13,15)
InChIKeyAJAGRYDBLGRURH-UHFFFAOYSA-N
XLogP1.83
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpyrazol-3-yl)acetamide?
The IUPAC name of N-(1-phenylpyrazol-3-yl)acetamide (CID 594242) is N-(1-phenylpyrazol-3-yl)acetamide.
What is the SMILES notation for N-(1-phenylpyrazol-3-yl)acetamide?
The canonical SMILES for N-(1-phenylpyrazol-3-yl)acetamide is CC(=O)Nc1ccn(-c2ccccc2)n1.
What is the InChIKey of N-(1-phenylpyrazol-3-yl)acetamide?
The InChIKey is AJAGRYDBLGRURH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-9(15)12-11-7-8-14(13-11)10-5-3-2-4-6-10/h2-8H,1H3,(H,12,13,15).
What are the key properties of N-(1-phenylpyrazol-3-yl)acetamide?
N-(1-phenylpyrazol-3-yl)acetamide has a molecular weight of 201.23 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 594242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).