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

C16H15NO4 — CID 6916060

IUPAC2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid
SMILESCOc1ccc(C(=O)NC(C(=O)O)c2ccccc2)cc1
InChIInChI=1S/C16H15NO4/c1-21-13-9-7-12(8-10-13)15(18)17-14(16(19)20)11-5-3-2-4-6-11/h2-10,14H,1H3,(H,17,18)(H,19,20)
InChIKeyMBNRIDZSQPHJRF-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.25
Rot. Bonds5

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

2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid (PubChem CID 6916060) has the molecular formula C16H15NO4 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid.

Molecular Properties

Compound Name2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid
PubChem CID6916060
Molecular FormulaC16H15NO4
Molecular Weight285.30 g/mol
Exact Mass285.10
IUPAC Name2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid
SMILESCOc1ccc(C(=O)NC(C(=O)O)c2ccccc2)cc1
InChIInChI=1S/C16H15NO4/c1-21-13-9-7-12(8-10-13)15(18)17-14(16(19)20)11-5-3-2-4-6-11/h2-10,14H,1H3,(H,17,18)(H,19,20)
InChIKeyMBNRIDZSQPHJRF-UHFFFAOYSA-N
XLogP2.25
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.25
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]-2-phenylacetic acid?
The IUPAC name of 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid (CID 6916060) is 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid.
What is the SMILES notation for 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid?
The canonical SMILES for 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid is COc1ccc(C(=O)NC(C(=O)O)c2ccccc2)cc1.
What is the InChIKey of 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid?
The InChIKey is MBNRIDZSQPHJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO4/c1-21-13-9-7-12(8-10-13)15(18)17-14(16(19)20)11-5-3-2-4-6-11/h2-10,14H,1H3,(H,17,18)(H,19,20).
What are the key properties of 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid?
2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid has a molecular weight of 285.30 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxybenzoyl)amino]-2-phenylacetic acid is sourced from PubChem (CID 6916060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).