2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide

C19H19N3O — CID 110716549

IUPAC2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide
SMILESO=C(NCCn1cccn1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H19N3O/c23-19(20-13-15-22-14-7-12-21-22)18(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-12,14,18H,13,15H2,(H,20,23)
InChIKeyOSHUGSBMACEVCR-UHFFFAOYSA-N
MW305.38 g/mol
LogP2.83
Rot. Bonds6

About 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide

2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide (PubChem CID 110716549) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide
PubChem CID110716549
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide
SMILESO=C(NCCn1cccn1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H19N3O/c23-19(20-13-15-22-14-7-12-21-22)18(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-12,14,18H,13,15H2,(H,20,23)
InChIKeyOSHUGSBMACEVCR-UHFFFAOYSA-N
XLogP2.83
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide?
The IUPAC name of 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide (CID 110716549) is 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide.
What is the SMILES notation for 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide?
The canonical SMILES for 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide is O=C(NCCn1cccn1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide?
The InChIKey is OSHUGSBMACEVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c23-19(20-13-15-22-14-7-12-21-22)18(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-12,14,18H,13,15H2,(H,20,23).
What are the key properties of 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide?
2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide has a molecular weight of 305.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-(2-pyrazol-1-ylethyl)acetamide is sourced from PubChem (CID 110716549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).