N-hydroxy-4-(5-phenylpentanoylamino)benzamide

C18H20N2O3 — CID 11472431

IUPACN-hydroxy-4-(5-phenylpentanoylamino)benzamide
SMILESO=C(CCCCc1ccccc1)Nc1ccc(C(=O)NO)cc1
InChIInChI=1S/C18H20N2O3/c21-17(9-5-4-8-14-6-2-1-3-7-14)19-16-12-10-15(11-13-16)18(22)20-23/h1-3,6-7,10-13,23H,4-5,8-9H2,(H,19,21)(H,20,22)
InChIKeyZCTKPFZOLLIQQR-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.16
Rot. Bonds7

About N-hydroxy-4-(5-phenylpentanoylamino)benzamide

N-hydroxy-4-(5-phenylpentanoylamino)benzamide (PubChem CID 11472431) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-hydroxy-4-(5-phenylpentanoylamino)benzamide.

Molecular Properties

Compound NameN-hydroxy-4-(5-phenylpentanoylamino)benzamide
PubChem CID11472431
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-hydroxy-4-(5-phenylpentanoylamino)benzamide
SMILESO=C(CCCCc1ccccc1)Nc1ccc(C(=O)NO)cc1
InChIInChI=1S/C18H20N2O3/c21-17(9-5-4-8-14-6-2-1-3-7-14)19-16-12-10-15(11-13-16)18(22)20-23/h1-3,6-7,10-13,23H,4-5,8-9H2,(H,19,21)(H,20,22)
InChIKeyZCTKPFZOLLIQQR-UHFFFAOYSA-N
XLogP3.16
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(5-phenylpentanoylamino)benzamide?
The IUPAC name of N-hydroxy-4-(5-phenylpentanoylamino)benzamide (CID 11472431) is N-hydroxy-4-(5-phenylpentanoylamino)benzamide.
What is the SMILES notation for N-hydroxy-4-(5-phenylpentanoylamino)benzamide?
The canonical SMILES for N-hydroxy-4-(5-phenylpentanoylamino)benzamide is O=C(CCCCc1ccccc1)Nc1ccc(C(=O)NO)cc1.
What is the InChIKey of N-hydroxy-4-(5-phenylpentanoylamino)benzamide?
The InChIKey is ZCTKPFZOLLIQQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c21-17(9-5-4-8-14-6-2-1-3-7-14)19-16-12-10-15(11-13-16)18(22)20-23/h1-3,6-7,10-13,23H,4-5,8-9H2,(H,19,21)(H,20,22).
What are the key properties of N-hydroxy-4-(5-phenylpentanoylamino)benzamide?
N-hydroxy-4-(5-phenylpentanoylamino)benzamide has a molecular weight of 312.37 g/mol, XLogP of 3.16, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-(5-phenylpentanoylamino)benzamide is sourced from PubChem (CID 11472431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).