N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide

C15H12Cl2N2O4 — CID 11416940

IUPACN-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide
SMILESCc1cccc(O)c1NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C15H12Cl2N2O4/c1-7-3-2-4-11(20)12(7)19-15(23)14(22)18-10-6-8(16)5-9(17)13(10)21/h2-6,20-21H,1H3,(H,18,22)(H,19,23)
InChIKeyODZOGCWPMWFUDO-UHFFFAOYSA-N
MW355.18 g/mol
LogP3.29
Rot. Bonds2

About N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide

N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide (PubChem CID 11416940) has the molecular formula C15H12Cl2N2O4 and a molecular weight of 355.18 g/mol. Its IUPAC name is N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide
PubChem CID11416940
Molecular FormulaC15H12Cl2N2O4
Molecular Weight355.18 g/mol
Exact Mass354.02
IUPAC NameN-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide
SMILESCc1cccc(O)c1NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C15H12Cl2N2O4/c1-7-3-2-4-11(20)12(7)19-15(23)14(22)18-10-6-8(16)5-9(17)13(10)21/h2-6,20-21H,1H3,(H,18,22)(H,19,23)
InChIKeyODZOGCWPMWFUDO-UHFFFAOYSA-N
XLogP3.29
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.18
LogP ≤ 53.29
H-Bond Donors ≤ 54
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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Related Compounds

N-(3,5-dichloro-2-hydroxy-4-methylphenyl)-N'-(3,5-dichloro-2-hydroxyphenyl)oxamide
CID 11293160
2-bromo-N-(3,5-dichloro-2-hydroxyphenyl)-3-methylbenzamide
CID 104625899
N-(3,5-dichloro-2-hydroxyphenyl)-4-hydroxy-3-methylbenzamide
CID 103958263
N'-(3,5-dichloro-2-hydroxyphenyl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)oxamide
CID 11750845
N,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
N-(3,5-dichloro-2-hydroxyphenyl)-2-hydroxybenzamide
CID 3067488
N-(3,5-dichloro-2-hydroxyphenyl)-N'-(3,5-dichloro-2-pyridinyl)oxamide
CID 11338414
N-(3,5-dichloro-2-hydroxyphenyl)-2,2-dimethylpropanamide
CID 103891250
N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108516687
N-(3,5-dichloro-2-hydroxyphenyl)-3,5-dimethylbenzamide
CID 107675698
N-(4-chloro-2-methylphenyl)-N'-(2-ethyl-6-methylphenyl)oxamide
CID 108512069
4-chloro-N-(3,5-dichloro-2-hydroxyphenyl)benzamide
CID 107675874

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide?
The IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide (CID 11416940) is N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide.
What is the SMILES notation for N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide?
The canonical SMILES for N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide is Cc1cccc(O)c1NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1O.
What is the InChIKey of N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide?
The InChIKey is ODZOGCWPMWFUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O4/c1-7-3-2-4-11(20)12(7)19-15(23)14(22)18-10-6-8(16)5-9(17)13(10)21/h2-6,20-21H,1H3,(H,18,22)(H,19,23).
What are the key properties of N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide?
N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide has a molecular weight of 355.18 g/mol, XLogP of 3.29, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-2-hydroxyphenyl)-N'-(2-hydroxy-6-methylphenyl)oxamide is sourced from PubChem (CID 11416940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).