N-(3,4,5-triphenylpyrazol-4-yl)acetamide

C23H19N3O — CID 10665770

IUPACN-(3,4,5-triphenylpyrazol-4-yl)acetamide
SMILESCC(=O)NC1(c2ccccc2)C(c2ccccc2)=NN=C1c1ccccc1
InChIInChI=1S/C23H19N3O/c1-17(27)24-23(20-15-9-4-10-16-20)21(18-11-5-2-6-12-18)25-26-22(23)19-13-7-3-8-14-19/h2-16H,1H3,(H,24,27)
InChIKeyBOXULRWRLGQKPN-UHFFFAOYSA-N
MW353.43 g/mol
LogP3.93
Rot. Bonds4

About N-(3,4,5-triphenylpyrazol-4-yl)acetamide

N-(3,4,5-triphenylpyrazol-4-yl)acetamide (PubChem CID 10665770) has the molecular formula C23H19N3O and a molecular weight of 353.43 g/mol. Its IUPAC name is N-(3,4,5-triphenylpyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(3,4,5-triphenylpyrazol-4-yl)acetamide
PubChem CID10665770
Molecular FormulaC23H19N3O
Molecular Weight353.43 g/mol
Exact Mass353.15
IUPAC NameN-(3,4,5-triphenylpyrazol-4-yl)acetamide
SMILESCC(=O)NC1(c2ccccc2)C(c2ccccc2)=NN=C1c1ccccc1
InChIInChI=1S/C23H19N3O/c1-17(27)24-23(20-15-9-4-10-16-20)21(18-11-5-2-6-12-18)25-26-22(23)19-13-7-3-8-14-19/h2-16H,1H3,(H,24,27)
InChIKeyBOXULRWRLGQKPN-UHFFFAOYSA-N
XLogP3.93
TPSA53.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4,5-triphenylpyrazol-4-yl)acetamide?
The IUPAC name of N-(3,4,5-triphenylpyrazol-4-yl)acetamide (CID 10665770) is N-(3,4,5-triphenylpyrazol-4-yl)acetamide.
What is the SMILES notation for N-(3,4,5-triphenylpyrazol-4-yl)acetamide?
The canonical SMILES for N-(3,4,5-triphenylpyrazol-4-yl)acetamide is CC(=O)NC1(c2ccccc2)C(c2ccccc2)=NN=C1c1ccccc1.
What is the InChIKey of N-(3,4,5-triphenylpyrazol-4-yl)acetamide?
The InChIKey is BOXULRWRLGQKPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O/c1-17(27)24-23(20-15-9-4-10-16-20)21(18-11-5-2-6-12-18)25-26-22(23)19-13-7-3-8-14-19/h2-16H,1H3,(H,24,27).
What are the key properties of N-(3,4,5-triphenylpyrazol-4-yl)acetamide?
N-(3,4,5-triphenylpyrazol-4-yl)acetamide has a molecular weight of 353.43 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4,5-triphenylpyrazol-4-yl)acetamide is sourced from PubChem (CID 10665770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).