3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide

C22H20N2O4 — CID 18626235

IUPAC3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(O)c1ccccc1
InChIInChI=1S/C22H20N2O4/c1-28-19-13-12-16(21(26)23-17-10-6-3-7-11-17)14-18(19)24-22(27)20(25)15-8-4-2-5-9-15/h2-14,20,25H,1H3,(H,23,26)(H,24,27)
InChIKeyNCOOPIJEPPBLLO-UHFFFAOYSA-N
MW376.41 g/mol
LogP3.62
Rot. Bonds6

About 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide

3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide (PubChem CID 18626235) has the molecular formula C22H20N2O4 and a molecular weight of 376.41 g/mol. Its IUPAC name is 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide.

Molecular Properties

Compound Name3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide
PubChem CID18626235
Molecular FormulaC22H20N2O4
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC Name3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(O)c1ccccc1
InChIInChI=1S/C22H20N2O4/c1-28-19-13-12-16(21(26)23-17-10-6-3-7-11-17)14-18(19)24-22(27)20(25)15-8-4-2-5-9-15/h2-14,20,25H,1H3,(H,23,26)(H,24,27)
InChIKeyNCOOPIJEPPBLLO-UHFFFAOYSA-N
XLogP3.62
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 53.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide?
The IUPAC name of 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide (CID 18626235) is 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide.
What is the SMILES notation for 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide?
The canonical SMILES for 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide is COc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(O)c1ccccc1.
What is the InChIKey of 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide?
The InChIKey is NCOOPIJEPPBLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4/c1-28-19-13-12-16(21(26)23-17-10-6-3-7-11-17)14-18(19)24-22(27)20(25)15-8-4-2-5-9-15/h2-14,20,25H,1H3,(H,23,26)(H,24,27).
What are the key properties of 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide?
3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide has a molecular weight of 376.41 g/mol, XLogP of 3.62, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methoxy-N-phenylbenzamide is sourced from PubChem (CID 18626235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).