N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide

C11H11N3O2 — CID 28788954

IUPACN-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1ccc(O)cc1
InChIInChI=1S/C11H11N3O2/c15-10-4-2-9(3-5-10)13-11(16)8-14-7-1-6-12-14/h1-7,15H,8H2,(H,13,16)
InChIKeyBSUVSWPKCMWXTE-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.23
Rot. Bonds3

About N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide

N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide (PubChem CID 28788954) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide
PubChem CID28788954
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC NameN-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1ccc(O)cc1
InChIInChI=1S/C11H11N3O2/c15-10-4-2-9(3-5-10)13-11(16)8-14-7-1-6-12-14/h1-7,15H,8H2,(H,13,16)
InChIKeyBSUVSWPKCMWXTE-UHFFFAOYSA-N
XLogP1.23
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide (CID 28788954) is N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide is O=C(Cn1cccn1)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide?
The InChIKey is BSUVSWPKCMWXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c15-10-4-2-9(3-5-10)13-11(16)8-14-7-1-6-12-14/h1-7,15H,8H2,(H,13,16).
What are the key properties of N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide?
N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide has a molecular weight of 217.23 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 28788954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).