3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide

C15H20N2O3 — CID 54581111

IUPAC3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide
SMILESO=C(CCC1CCN(C(=O)c2ccccc2)CC1)NO
InChIInChI=1S/C15H20N2O3/c18-14(16-20)7-6-12-8-10-17(11-9-12)15(19)13-4-2-1-3-5-13/h1-5,12,20H,6-11H2,(H,16,18)
InChIKeyRWBBRVYFAHTHSI-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.82
Rot. Bonds4

About 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide

3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide (PubChem CID 54581111) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide.

Molecular Properties

Compound Name3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide
PubChem CID54581111
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide
SMILESO=C(CCC1CCN(C(=O)c2ccccc2)CC1)NO
InChIInChI=1S/C15H20N2O3/c18-14(16-20)7-6-12-8-10-17(11-9-12)15(19)13-4-2-1-3-5-13/h1-5,12,20H,6-11H2,(H,16,18)
InChIKeyRWBBRVYFAHTHSI-UHFFFAOYSA-N
XLogP1.82
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.82
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 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide?
The IUPAC name of 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide (CID 54581111) is 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide.
What is the SMILES notation for 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide?
The canonical SMILES for 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide is O=C(CCC1CCN(C(=O)c2ccccc2)CC1)NO.
What is the InChIKey of 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide?
The InChIKey is RWBBRVYFAHTHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c18-14(16-20)7-6-12-8-10-17(11-9-12)15(19)13-4-2-1-3-5-13/h1-5,12,20H,6-11H2,(H,16,18).
What are the key properties of 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide?
3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide has a molecular weight of 276.34 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzoylpiperidin-4-yl)-N-hydroxypropanamide is sourced from PubChem (CID 54581111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).