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

C11H11N3O2 — CID 43540289

IUPAC3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide
SMILESCc1ccc(C(=O)Nc2cn[nH]c2)cc1O
InChIInChI=1S/C11H11N3O2/c1-7-2-3-8(4-10(7)15)11(16)14-9-5-12-13-6-9/h2-6,15H,1H3,(H,12,13)(H,14,16)
InChIKeyZAZWCNOPRWURPF-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.68
Rot. Bonds2

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

3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide (PubChem CID 43540289) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide.

Molecular Properties

Compound Name3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide
PubChem CID43540289
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide
SMILESCc1ccc(C(=O)Nc2cn[nH]c2)cc1O
InChIInChI=1S/C11H11N3O2/c1-7-2-3-8(4-10(7)15)11(16)14-9-5-12-13-6-9/h2-6,15H,1H3,(H,12,13)(H,14,16)
InChIKeyZAZWCNOPRWURPF-UHFFFAOYSA-N
XLogP1.68
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-N-(1H-pyrazol-4-yl)benzamide
CID 43429529
4-hydroxy-N-(1H-pyrazol-4-yl)benzamide
CID 43540288
4-methoxy-N-(1H-pyrazol-4-yl)benzamide
CID 43429414
3-amino-4-chloro-N-(1H-pyrazol-4-yl)benzamide
CID 43539715
3-amino-N-(1H-pyrazol-4-yl)benzamide
CID 43539714
5-N-(1H-pyrazol-4-yl)pyridine-2,5-dicarboxamide
CID 86858757
2-amino-N-(1H-pyrazol-4-yl)pyridine-4-carboxamide
CID 62154464
3-chloro-N-(1H-pyrazol-4-yl)benzamide
CID 43429419
4-hydroxy-N-(1H-pyrazol-4-yl)-1-benzothiophene-6-carboxamide
CID 166228868
2,6-difluoro-3-methyl-N-(1H-pyrazol-4-yl)benzamide
CID 82816091
4-(methylamino)-N-(1H-pyrazol-4-yl)-3-(trifluoromethyl)benzamide
CID 62169200
3-hydroxy-N-[4-(hydroxymethyl)phenyl]-4-methylbenzamide
CID 64792997

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide?
The IUPAC name of 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide (CID 43540289) is 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide.
What is the SMILES notation for 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide?
The canonical SMILES for 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide is Cc1ccc(C(=O)Nc2cn[nH]c2)cc1O.
What is the InChIKey of 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide?
The InChIKey is ZAZWCNOPRWURPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c1-7-2-3-8(4-10(7)15)11(16)14-9-5-12-13-6-9/h2-6,15H,1H3,(H,12,13)(H,14,16).
What are the key properties of 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide?
3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide has a molecular weight of 217.23 g/mol, XLogP of 1.68, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methyl-N-(1H-pyrazol-4-yl)benzamide is sourced from PubChem (CID 43540289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).