2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide

C17H13Cl2N3O2 — CID 167744959

IUPAC2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)C(O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H13Cl2N3O2/c18-12-8-11(9-13(19)10-12)16(23)17(24)21-14-2-4-15(5-3-14)22-7-1-6-20-22/h1-10,16,23H,(H,21,24)
InChIKeyCQNGABVLLQFBDY-UHFFFAOYSA-N
MW362.22 g/mol
LogP3.85
Rot. Bonds4

About 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide

2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide (PubChem CID 167744959) has the molecular formula C17H13Cl2N3O2 and a molecular weight of 362.22 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide
PubChem CID167744959
Molecular FormulaC17H13Cl2N3O2
Molecular Weight362.22 g/mol
Exact Mass361.04
IUPAC Name2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide
SMILESO=C(Nc1ccc(-n2cccn2)cc1)C(O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H13Cl2N3O2/c18-12-8-11(9-13(19)10-12)16(23)17(24)21-14-2-4-15(5-3-14)22-7-1-6-20-22/h1-10,16,23H,(H,21,24)
InChIKeyCQNGABVLLQFBDY-UHFFFAOYSA-N
XLogP3.85
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.22
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide?
The IUPAC name of 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide (CID 167744959) is 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide?
The canonical SMILES for 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide is O=C(Nc1ccc(-n2cccn2)cc1)C(O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide?
The InChIKey is CQNGABVLLQFBDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2N3O2/c18-12-8-11(9-13(19)10-12)16(23)17(24)21-14-2-4-15(5-3-14)22-7-1-6-20-22/h1-10,16,23H,(H,21,24).
What are the key properties of 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide?
2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide has a molecular weight of 362.22 g/mol, XLogP of 3.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)-2-hydroxy-N-(4-pyrazol-1-ylphenyl)acetamide is sourced from PubChem (CID 167744959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).