methyl 4-[(3-hydroxybenzoyl)amino]benzoate

C15H13NO4 — CID 43404225

IUPACmethyl 4-[(3-hydroxybenzoyl)amino]benzoate
SMILESCOC(=O)c1ccc(NC(=O)c2cccc(O)c2)cc1
InChIInChI=1S/C15H13NO4/c1-20-15(19)10-5-7-12(8-6-10)16-14(18)11-3-2-4-13(17)9-11/h2-9,17H,1H3,(H,16,18)
InChIKeyRVXZLFICJJGMGQ-UHFFFAOYSA-N
MW271.27 g/mol
LogP2.43
Rot. Bonds3

About methyl 4-[(3-hydroxybenzoyl)amino]benzoate

methyl 4-[(3-hydroxybenzoyl)amino]benzoate (PubChem CID 43404225) has the molecular formula C15H13NO4 and a molecular weight of 271.27 g/mol. Its IUPAC name is methyl 4-[(3-hydroxybenzoyl)amino]benzoate.

Molecular Properties

Compound Namemethyl 4-[(3-hydroxybenzoyl)amino]benzoate
PubChem CID43404225
Molecular FormulaC15H13NO4
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Namemethyl 4-[(3-hydroxybenzoyl)amino]benzoate
SMILESCOC(=O)c1ccc(NC(=O)c2cccc(O)c2)cc1
InChIInChI=1S/C15H13NO4/c1-20-15(19)10-5-7-12(8-6-10)16-14(18)11-3-2-4-13(17)9-11/h2-9,17H,1H3,(H,16,18)
InChIKeyRVXZLFICJJGMGQ-UHFFFAOYSA-N
XLogP2.43
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[[[4-[(3-methylbenzoyl)amino]benzoyl]amino]carbamoyl]benzoate
CID 17178369
3-hydroxy-N-(4-methylphenyl)benzamide
CID 10900357
methyl 4-[[4-[(4-hydroxyphenyl)carbamoyl]phenyl]carbamoyl]benzoate
CID 3353390
methyl 3-[(4-acetamidophenyl)carbamoyl]benzoate
CID 17175145
methyl 3-[(4-carbamoylphenyl)carbamoyl]benzoate
CID 17175176
methyl 4-[(3-hydroxy-5-methylbenzoyl)amino]benzoate
CID 176550811
tert-butyl N-[4-[(3-hydroxybenzoyl)amino]phenyl]carbamate
CID 131844196
methyl 4-[[3-(methylsulfamoyl)benzoyl]amino]benzoate
CID 26583048
methyl 4-[[2-[(3-methylbenzoyl)amino]benzoyl]amino]benzoate
CID 112762906
methyl 3-[[(4-acetamidobenzoyl)amino]carbamoyl]benzoate
CID 17175396
methyl 4-[[3-[(3-cyanophenyl)carbamoyl]benzoyl]amino]benzoate
CID 109057740
methyl 4-[(3-propoxybenzoyl)amino]benzoate
CID 2293242

Frequently Asked Questions

What is the IUPAC name of methyl 4-[(3-hydroxybenzoyl)amino]benzoate?
The IUPAC name of methyl 4-[(3-hydroxybenzoyl)amino]benzoate (CID 43404225) is methyl 4-[(3-hydroxybenzoyl)amino]benzoate.
What is the SMILES notation for methyl 4-[(3-hydroxybenzoyl)amino]benzoate?
The canonical SMILES for methyl 4-[(3-hydroxybenzoyl)amino]benzoate is COC(=O)c1ccc(NC(=O)c2cccc(O)c2)cc1.
What is the InChIKey of methyl 4-[(3-hydroxybenzoyl)amino]benzoate?
The InChIKey is RVXZLFICJJGMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO4/c1-20-15(19)10-5-7-12(8-6-10)16-14(18)11-3-2-4-13(17)9-11/h2-9,17H,1H3,(H,16,18).
What are the key properties of methyl 4-[(3-hydroxybenzoyl)amino]benzoate?
methyl 4-[(3-hydroxybenzoyl)amino]benzoate has a molecular weight of 271.27 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[(3-hydroxybenzoyl)amino]benzoate is sourced from PubChem (CID 43404225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).