N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide

C15H15N3O3 — CID 108502143

IUPACN'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide
SMILESCc1ccc(N)c(NC(=O)C(=O)Nc2ccc(O)cc2)c1
InChIInChI=1S/C15H15N3O3/c1-9-2-7-12(16)13(8-9)18-15(21)14(20)17-10-3-5-11(19)6-4-10/h2-8,19H,16H2,1H3,(H,17,20)(H,18,21)
InChIKeyQMVXGSFXLQGNDV-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.86
Rot. Bonds2

About N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide

N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide (PubChem CID 108502143) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide
PubChem CID108502143
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide
SMILESCc1ccc(N)c(NC(=O)C(=O)Nc2ccc(O)cc2)c1
InChIInChI=1S/C15H15N3O3/c1-9-2-7-12(16)13(8-9)18-15(21)14(20)17-10-3-5-11(19)6-4-10/h2-8,19H,16H2,1H3,(H,17,20)(H,18,21)
InChIKeyQMVXGSFXLQGNDV-UHFFFAOYSA-N
XLogP1.86
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.86
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide?
The IUPAC name of N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide (CID 108502143) is N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide.
What is the SMILES notation for N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide?
The canonical SMILES for N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide is Cc1ccc(N)c(NC(=O)C(=O)Nc2ccc(O)cc2)c1.
What is the InChIKey of N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide?
The InChIKey is QMVXGSFXLQGNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-9-2-7-12(16)13(8-9)18-15(21)14(20)17-10-3-5-11(19)6-4-10/h2-8,19H,16H2,1H3,(H,17,20)(H,18,21).
What are the key properties of N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide?
N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide has a molecular weight of 285.30 g/mol, XLogP of 1.86, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide is sourced from PubChem (CID 108502143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).