N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide

C24H24N2O3 — CID 147494656

IUPACN-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide
SMILESO=C(NO)c1ccc(CN(CCc2ccccc2)C(=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H24N2O3/c27-23(17-20-9-5-2-6-10-20)26(16-15-19-7-3-1-4-8-19)18-21-11-13-22(14-12-21)24(28)25-29/h1-14,29H,15-18H2,(H,25,28)
InChIKeyFGFADNWOFJLWQU-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.62
Rot. Bonds8

About N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide

N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide (PubChem CID 147494656) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide
PubChem CID147494656
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide
SMILESO=C(NO)c1ccc(CN(CCc2ccccc2)C(=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H24N2O3/c27-23(17-20-9-5-2-6-10-20)26(16-15-19-7-3-1-4-8-19)18-21-11-13-22(14-12-21)24(28)25-29/h1-14,29H,15-18H2,(H,25,28)
InChIKeyFGFADNWOFJLWQU-UHFFFAOYSA-N
XLogP3.62
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
The IUPAC name of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide (CID 147494656) is N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
The canonical SMILES for N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide is O=C(NO)c1ccc(CN(CCc2ccccc2)C(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
The InChIKey is FGFADNWOFJLWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c27-23(17-20-9-5-2-6-10-20)26(16-15-19-7-3-1-4-8-19)18-21-11-13-22(14-12-21)24(28)25-29/h1-14,29H,15-18H2,(H,25,28).
What are the key properties of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide is sourced from PubChem (CID 147494656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).