4-hydroxy-3-(1H-pyrazol-5-yl)benzamide

C10H9N3O2 — CID 174574401

IUPAC4-hydroxy-3-(1H-pyrazol-5-yl)benzamide
SMILESNC(=O)c1ccc(O)c(-c2ccn[nH]2)c1
InChIInChI=1S/C10H9N3O2/c11-10(15)6-1-2-9(14)7(5-6)8-3-4-12-13-8/h1-5,14H,(H2,11,15)(H,12,13)
InChIKeyLLHFBMRNWWBKEC-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.88
Rot. Bonds2

About 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide

4-hydroxy-3-(1H-pyrazol-5-yl)benzamide (PubChem CID 174574401) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name4-hydroxy-3-(1H-pyrazol-5-yl)benzamide
PubChem CID174574401
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name4-hydroxy-3-(1H-pyrazol-5-yl)benzamide
SMILESNC(=O)c1ccc(O)c(-c2ccn[nH]2)c1
InChIInChI=1S/C10H9N3O2/c11-10(15)6-1-2-9(14)7(5-6)8-3-4-12-13-8/h1-5,14H,(H2,11,15)(H,12,13)
InChIKeyLLHFBMRNWWBKEC-UHFFFAOYSA-N
XLogP0.88
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide?
The IUPAC name of 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide (CID 174574401) is 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide is NC(=O)c1ccc(O)c(-c2ccn[nH]2)c1.
What is the InChIKey of 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide?
The InChIKey is LLHFBMRNWWBKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c11-10(15)6-1-2-9(14)7(5-6)8-3-4-12-13-8/h1-5,14H,(H2,11,15)(H,12,13).
What are the key properties of 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide?
4-hydroxy-3-(1H-pyrazol-5-yl)benzamide has a molecular weight of 203.20 g/mol, XLogP of 0.88, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-(1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 174574401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).