2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide

C15H15NO3 — CID 103892363

IUPAC2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide
SMILESCc1cccc(N(C)C(=O)c2cc(O)ccc2O)c1
InChIInChI=1S/C15H15NO3/c1-10-4-3-5-11(8-10)16(2)15(19)13-9-12(17)6-7-14(13)18/h3-9,17-18H,1-2H3
InChIKeyVPIOFNXXXPEDRT-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.68
Rot. Bonds2

About 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide

2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide (PubChem CID 103892363) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide
PubChem CID103892363
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide
SMILESCc1cccc(N(C)C(=O)c2cc(O)ccc2O)c1
InChIInChI=1S/C15H15NO3/c1-10-4-3-5-11(8-10)16(2)15(19)13-9-12(17)6-7-14(13)18/h3-9,17-18H,1-2H3
InChIKeyVPIOFNXXXPEDRT-UHFFFAOYSA-N
XLogP2.68
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-dihydroxy-N-methyl-N-phenylbenzamide
CID 113347039
N,2-dimethyl-N-(3-methylphenyl)benzamide;ethane
CID 91376275
2-amino-5-hydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107733144
2,4-dibromo-N-methyl-N-(3-methylphenyl)benzamide
CID 107952311
4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide
CID 107735629
2-fluoro-4-hydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735649
4-amino-2-fluoro-N-methyl-N-(3-methylphenyl)benzamide
CID 62002180
2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide
CID 62003309
2-amino-N-(3-fluorophenyl)-5-hydroxy-N-methylbenzamide
CID 107075081
3,4-dihydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735623
N-methyl-4-(methylamino)-N-(3-methylphenyl)benzamide
CID 62175593
3-hydroxy-4-methoxy-N-methyl-N-(3-methylphenyl)benzamide
CID 79726183

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide?
The IUPAC name of 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide (CID 103892363) is 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide?
The canonical SMILES for 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide is Cc1cccc(N(C)C(=O)c2cc(O)ccc2O)c1.
What is the InChIKey of 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide?
The InChIKey is VPIOFNXXXPEDRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-10-4-3-5-11(8-10)16(2)15(19)13-9-12(17)6-7-14(13)18/h3-9,17-18H,1-2H3.
What are the key properties of 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide?
2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide has a molecular weight of 257.29 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 103892363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).