N-(2,4-dihydroxyphenyl)-4-methoxybenzamide

C14H13NO4 — CID 141075428

IUPACN-(2,4-dihydroxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(O)cc2O)cc1
InChIInChI=1S/C14H13NO4/c1-19-11-5-2-9(3-6-11)14(18)15-12-7-4-10(16)8-13(12)17/h2-8,16-17H,1H3,(H,15,18)
InChIKeyBSXUDNLLPQOATB-UHFFFAOYSA-N
MW259.26 g/mol
LogP2.36
Rot. Bonds3

About N-(2,4-dihydroxyphenyl)-4-methoxybenzamide

N-(2,4-dihydroxyphenyl)-4-methoxybenzamide (PubChem CID 141075428) has the molecular formula C14H13NO4 and a molecular weight of 259.26 g/mol. Its IUPAC name is N-(2,4-dihydroxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(2,4-dihydroxyphenyl)-4-methoxybenzamide
PubChem CID141075428
Molecular FormulaC14H13NO4
Molecular Weight259.26 g/mol
Exact Mass259.08
IUPAC NameN-(2,4-dihydroxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(O)cc2O)cc1
InChIInChI=1S/C14H13NO4/c1-19-11-5-2-9(3-6-11)14(18)15-12-7-4-10(16)8-13(12)17/h2-8,16-17H,1H3,(H,15,18)
InChIKeyBSXUDNLLPQOATB-UHFFFAOYSA-N
XLogP2.36
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-dihydroxyphenyl)-4-hydroxybenzamide
CID 171363826
N-(2-chloro-4-hydroxyphenyl)-4-methoxybenzamide;N-(2-chloro-4-methoxyphenyl)-4-methoxybenzamide
CID 86605166
N-[2-amino-5-(4-hydroxyphenyl)phenyl]-4-methoxybenzamide
CID 59736664
4-hydroxy-N-(2-hydroxy-4-methylphenyl)benzamide
CID 60654456
4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide
CID 102695314
N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide
CID 59736690
N-[4-hydroxy-2-[(4-propylphenyl)methylamino]phenyl]-4-methoxybenzamide
CID 86585756
N-(2-bromo-5-methoxyphenyl)-4-methoxybenzamide
CID 62416430
N-(2-chloro-4-iodophenyl)-4-methoxybenzamide
CID 1370705
3-amino-4-[(4-methoxybenzoyl)amino]benzoic acid
CID 63117294
3-hydroxy-4-[(3-methoxybenzoyl)amino]benzoic acid
CID 60827348
N-(2,4-dihydroxyphenyl)-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carboxamide
CID 166326596

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dihydroxyphenyl)-4-methoxybenzamide?
The IUPAC name of N-(2,4-dihydroxyphenyl)-4-methoxybenzamide (CID 141075428) is N-(2,4-dihydroxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for N-(2,4-dihydroxyphenyl)-4-methoxybenzamide?
The canonical SMILES for N-(2,4-dihydroxyphenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(O)cc2O)cc1.
What is the InChIKey of N-(2,4-dihydroxyphenyl)-4-methoxybenzamide?
The InChIKey is BSXUDNLLPQOATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO4/c1-19-11-5-2-9(3-6-11)14(18)15-12-7-4-10(16)8-13(12)17/h2-8,16-17H,1H3,(H,15,18).
What are the key properties of N-(2,4-dihydroxyphenyl)-4-methoxybenzamide?
N-(2,4-dihydroxyphenyl)-4-methoxybenzamide has a molecular weight of 259.26 g/mol, XLogP of 2.36, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dihydroxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 141075428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).