N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide

C19H19N3O2 — CID 52847994

IUPACN-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide
SMILESCc1cc(C)n(-c2ccccc2NC(=O)Cc2ccccc2O)n1
InChIInChI=1S/C19H19N3O2/c1-13-11-14(2)22(21-13)17-9-5-4-8-16(17)20-19(24)12-15-7-3-6-10-18(15)23/h3-11,23H,12H2,1-2H3,(H,20,24)
InChIKeyNNOSXSXPYBQXIR-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.38
Rot. Bonds4

About N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide

N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide (PubChem CID 52847994) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide
PubChem CID52847994
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide
SMILESCc1cc(C)n(-c2ccccc2NC(=O)Cc2ccccc2O)n1
InChIInChI=1S/C19H19N3O2/c1-13-11-14(2)22(21-13)17-9-5-4-8-16(17)20-19(24)12-15-7-3-6-10-18(15)23/h3-11,23H,12H2,1-2H3,(H,20,24)
InChIKeyNNOSXSXPYBQXIR-UHFFFAOYSA-N
XLogP3.38
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide (CID 52847994) is N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide is Cc1cc(C)n(-c2ccccc2NC(=O)Cc2ccccc2O)n1.
What is the InChIKey of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide?
The InChIKey is NNOSXSXPYBQXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-13-11-14(2)22(21-13)17-9-5-4-8-16(17)20-19(24)12-15-7-3-6-10-18(15)23/h3-11,23H,12H2,1-2H3,(H,20,24).
What are the key properties of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide?
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide has a molecular weight of 321.38 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 52847994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).