N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide

C17H15N3O — CID 39723144

IUPACN-(2-phenylphenyl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C17H15N3O/c21-17(13-20-12-6-11-18-20)19-16-10-5-4-9-15(16)14-7-2-1-3-8-14/h1-12H,13H2,(H,19,21)
InChIKeyGYMOTWHEYKXAJS-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.19
Rot. Bonds4

About N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide

N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide (PubChem CID 39723144) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(2-phenylphenyl)-2-pyrazol-1-ylacetamide
PubChem CID39723144
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-(2-phenylphenyl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C17H15N3O/c21-17(13-20-12-6-11-18-20)19-16-10-5-4-9-15(16)14-7-2-1-3-8-14/h1-12H,13H2,(H,19,21)
InChIKeyGYMOTWHEYKXAJS-UHFFFAOYSA-N
XLogP3.19
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide (CID 39723144) is N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide is O=C(Cn1cccn1)Nc1ccccc1-c1ccccc1.
What is the InChIKey of N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide?
The InChIKey is GYMOTWHEYKXAJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c21-17(13-20-12-6-11-18-20)19-16-10-5-4-9-15(16)14-7-2-1-3-8-14/h1-12H,13H2,(H,19,21).
What are the key properties of N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide?
N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide has a molecular weight of 277.33 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 39723144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).