N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide

C18H20N2O3 — CID 108512267

IUPACN'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)N(C)c2ccc(O)cc2)c(C)c1
InChIInChI=1S/C18H20N2O3/c1-11-9-12(2)16(13(3)10-11)19-17(22)18(23)20(4)14-5-7-15(21)8-6-14/h5-10,21H,1-4H3,(H,19,22)
InChIKeyBLJSUUMMRDVZDD-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.92
Rot. Bonds2

About N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide

N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide (PubChem CID 108512267) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide.

Molecular Properties

Compound NameN'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide
PubChem CID108512267
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)N(C)c2ccc(O)cc2)c(C)c1
InChIInChI=1S/C18H20N2O3/c1-11-9-12(2)16(13(3)10-11)19-17(22)18(23)20(4)14-5-7-15(21)8-6-14/h5-10,21H,1-4H3,(H,19,22)
InChIKeyBLJSUUMMRDVZDD-UHFFFAOYSA-N
XLogP2.92
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,6-dimethylphenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108528473
N-(2-chloro-4,6-dimethylphenyl)-N'-methyl-N'-phenyloxamide
CID 108521008
N-(4-hydroxy-2-methylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108509461
N-(2,4-difluorophenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108528497
N,N'-bis(2,4,6-trimethylphenyl)oxamide
CID 13271247
1-methyl-1-phenyl-3-(2,4,6-trimethylphenyl)urea
CID 108991139
1-[(4-hydroxyphenyl)methyl]-1-methyl-3-(2,4,6-trimethylphenyl)urea
CID 47031870
N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512317
N'-(4-hydroxyphenyl)-N'-methyl-N-(4-nitrophenyl)oxamide
CID 108513177
N-(3-chloro-4-methoxyphenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108501242
4-hydroxy-2-methyl-N-(2,4,6-trimethylphenyl)benzamide
CID 103863704
N'-(2,6-difluorophenyl)-N-(2,4,6-trimethylphenyl)oxamide
CID 108512223

Frequently Asked Questions

What is the IUPAC name of N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide?
The IUPAC name of N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide (CID 108512267) is N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide.
What is the SMILES notation for N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide?
The canonical SMILES for N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide is Cc1cc(C)c(NC(=O)C(=O)N(C)c2ccc(O)cc2)c(C)c1.
What is the InChIKey of N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide?
The InChIKey is BLJSUUMMRDVZDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-11-9-12(2)16(13(3)10-11)19-17(22)18(23)20(4)14-5-7-15(21)8-6-14/h5-10,21H,1-4H3,(H,19,22).
What are the key properties of N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide?
N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide has a molecular weight of 312.37 g/mol, XLogP of 2.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-hydroxyphenyl)-N'-methyl-N-(2,4,6-trimethylphenyl)oxamide is sourced from PubChem (CID 108512267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).