N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide

C15H15N3O3 — CID 108522685

IUPACN'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide
SMILESCc1ccc(O)c(NC(=O)C(=O)Nc2cccc(C)n2)c1
InChIInChI=1S/C15H15N3O3/c1-9-6-7-12(19)11(8-9)17-14(20)15(21)18-13-5-3-4-10(2)16-13/h3-8,19H,1-2H3,(H,17,20)(H,16,18,21)
InChIKeyJVAMXZCCADNNGO-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.98
Rot. Bonds2

About N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide

N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide (PubChem CID 108522685) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide.

Molecular Properties

Compound NameN'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide
PubChem CID108522685
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide
SMILESCc1ccc(O)c(NC(=O)C(=O)Nc2cccc(C)n2)c1
InChIInChI=1S/C15H15N3O3/c1-9-6-7-12(19)11(8-9)17-14(20)15(21)18-13-5-3-4-10(2)16-13/h3-8,19H,1-2H3,(H,17,20)(H,16,18,21)
InChIKeyJVAMXZCCADNNGO-UHFFFAOYSA-N
XLogP1.98
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide?
The IUPAC name of N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide (CID 108522685) is N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide.
What is the SMILES notation for N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide?
The canonical SMILES for N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide is Cc1ccc(O)c(NC(=O)C(=O)Nc2cccc(C)n2)c1.
What is the InChIKey of N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide?
The InChIKey is JVAMXZCCADNNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-9-6-7-12(19)11(8-9)17-14(20)15(21)18-13-5-3-4-10(2)16-13/h3-8,19H,1-2H3,(H,17,20)(H,16,18,21).
What are the key properties of N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide?
N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide has a molecular weight of 285.30 g/mol, XLogP of 1.98, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide is sourced from PubChem (CID 108522685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).