2-[(4-methoxybenzoyl)amino]benzoic acid

C15H13NO4 — CID 721421

IUPAC2-[(4-methoxybenzoyl)amino]benzoic acid
SMILESCOc1ccc(C(=O)Nc2ccccc2C(=O)O)cc1
InChIInChI=1S/C15H13NO4/c1-20-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)
InChIKeyFWDOQXWBHGKWRK-UHFFFAOYSA-N
MW271.27 g/mol
LogP2.65
Rot. Bonds4

About 2-[(4-methoxybenzoyl)amino]benzoic acid

2-[(4-methoxybenzoyl)amino]benzoic acid (PubChem CID 721421) has the molecular formula C15H13NO4 and a molecular weight of 271.27 g/mol. Its IUPAC name is 2-[(4-methoxybenzoyl)amino]benzoic acid.

Molecular Properties

Compound Name2-[(4-methoxybenzoyl)amino]benzoic acid
PubChem CID721421
Molecular FormulaC15H13NO4
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Name2-[(4-methoxybenzoyl)amino]benzoic acid
SMILESCOc1ccc(C(=O)Nc2ccccc2C(=O)O)cc1
InChIInChI=1S/C15H13NO4/c1-20-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)
InChIKeyFWDOQXWBHGKWRK-UHFFFAOYSA-N
XLogP2.65
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxybenzoyl)amino]benzoic acid?
The IUPAC name of 2-[(4-methoxybenzoyl)amino]benzoic acid (CID 721421) is 2-[(4-methoxybenzoyl)amino]benzoic acid.
What is the SMILES notation for 2-[(4-methoxybenzoyl)amino]benzoic acid?
The canonical SMILES for 2-[(4-methoxybenzoyl)amino]benzoic acid is COc1ccc(C(=O)Nc2ccccc2C(=O)O)cc1.
What is the InChIKey of 2-[(4-methoxybenzoyl)amino]benzoic acid?
The InChIKey is FWDOQXWBHGKWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO4/c1-20-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19).
What are the key properties of 2-[(4-methoxybenzoyl)amino]benzoic acid?
2-[(4-methoxybenzoyl)amino]benzoic acid has a molecular weight of 271.27 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxybenzoyl)amino]benzoic acid is sourced from PubChem (CID 721421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).