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

C11H10ClN3O2 — CID 55031730

IUPAC3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide
SMILESCc1cc(NC(=O)c2ccc(O)c(Cl)c2)n[nH]1
InChIInChI=1S/C11H10ClN3O2/c1-6-4-10(15-14-6)13-11(17)7-2-3-9(16)8(12)5-7/h2-5,16H,1H3,(H2,13,14,15,17)
InChIKeyHBWIPFRFDNCINX-UHFFFAOYSA-N
MW251.67 g/mol
LogP2.33
Rot. Bonds2

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

3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide (PubChem CID 55031730) has the molecular formula C11H10ClN3O2 and a molecular weight of 251.67 g/mol. Its IUPAC name is 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide.

Molecular Properties

Compound Name3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide
PubChem CID55031730
Molecular FormulaC11H10ClN3O2
Molecular Weight251.67 g/mol
Exact Mass251.05
IUPAC Name3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide
SMILESCc1cc(NC(=O)c2ccc(O)c(Cl)c2)n[nH]1
InChIInChI=1S/C11H10ClN3O2/c1-6-4-10(15-14-6)13-11(17)7-2-3-9(16)8(12)5-7/h2-5,16H,1H3,(H2,13,14,15,17)
InChIKeyHBWIPFRFDNCINX-UHFFFAOYSA-N
XLogP2.33
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.67
LogP ≤ 52.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-3-methyl-N-(5-methyl-1H-pyrazol-3-yl)benzamide
CID 113357499
3-[(3-chloro-4-hydroxybenzoyl)amino]-1H-pyrazole-5-carboxylic acid
CID 64528240
3-amino-4-bromo-N-(5-methyl-1H-pyrazol-3-yl)benzamide
CID 63819252
3-chloro-N-(5-ethyl-1H-pyrazol-3-yl)-4-fluorobenzamide
CID 113263522
4-chloro-N-(5-methyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 103872553
3-chloro-N-(5-methyl-1H-pyrazol-3-yl)thiophene-2-carboxamide
CID 80641240
N-(5-tert-butyl-1H-pyrazol-3-yl)-4-chloro-3-methylbenzamide
CID 115694776
2-N,6-N-bis(5-methyl-1H-pyrazol-3-yl)pyridine-2,6-dicarboxamide
CID 12073846
N-(5-tert-butyl-2-hydroxyphenyl)-3-chloro-4-hydroxybenzamide
CID 29265235
N-(5-methyl-1H-pyrazol-3-yl)pyridazine-4-carboxamide
CID 115736164
N-(5-methyl-1H-pyrazol-3-yl)-4-pyrrol-1-ylbenzamide
CID 47255659
1-methyl-N-(5-methyl-1H-pyrazol-3-yl)benzimidazole-5-carboxamide
CID 110469081

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide?
The IUPAC name of 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide (CID 55031730) is 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide.
What is the SMILES notation for 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide?
The canonical SMILES for 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide is Cc1cc(NC(=O)c2ccc(O)c(Cl)c2)n[nH]1.
What is the InChIKey of 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide?
The InChIKey is HBWIPFRFDNCINX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O2/c1-6-4-10(15-14-6)13-11(17)7-2-3-9(16)8(12)5-7/h2-5,16H,1H3,(H2,13,14,15,17).
What are the key properties of 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide?
3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide has a molecular weight of 251.67 g/mol, XLogP of 2.33, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)benzamide is sourced from PubChem (CID 55031730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).