2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide

C19H19N3O2 — CID 47721668

IUPAC2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide
SMILESCCOC(C(=O)Nc1ccn(-c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-2-24-18(15-9-5-3-6-10-15)19(23)20-17-13-14-22(21-17)16-11-7-4-8-12-16/h3-14,18H,2H2,1H3,(H,20,21,23)
InChIKeyIFKYEDRYCLVFRA-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.59
Rot. Bonds6

About 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide

2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide (PubChem CID 47721668) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide
PubChem CID47721668
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide
SMILESCCOC(C(=O)Nc1ccn(-c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-2-24-18(15-9-5-3-6-10-15)19(23)20-17-13-14-22(21-17)16-11-7-4-8-12-16/h3-14,18H,2H2,1H3,(H,20,21,23)
InChIKeyIFKYEDRYCLVFRA-UHFFFAOYSA-N
XLogP3.59
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide?
The IUPAC name of 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide (CID 47721668) is 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide is CCOC(C(=O)Nc1ccn(-c2ccccc2)n1)c1ccccc1.
What is the InChIKey of 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide?
The InChIKey is IFKYEDRYCLVFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-2-24-18(15-9-5-3-6-10-15)19(23)20-17-13-14-22(21-17)16-11-7-4-8-12-16/h3-14,18H,2H2,1H3,(H,20,21,23).
What are the key properties of 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide?
2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide has a molecular weight of 321.38 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 47721668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).