N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide

C19H28N2O3 — CID 87748028

IUPACN-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide
SMILESO=C(CCCC1CCN(C(=O)CCCc2ccccc2)CC1)NO
InChIInChI=1S/C19H28N2O3/c22-18(20-24)10-4-8-17-12-14-21(15-13-17)19(23)11-5-9-16-6-2-1-3-7-16/h1-3,6-7,17,24H,4-5,8-15H2,(H,20,22)
InChIKeyCMFQOTKQZFPECE-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.92
Rot. Bonds8

About N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide

N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide (PubChem CID 87748028) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide.

Molecular Properties

Compound NameN-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide
PubChem CID87748028
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide
SMILESO=C(CCCC1CCN(C(=O)CCCc2ccccc2)CC1)NO
InChIInChI=1S/C19H28N2O3/c22-18(20-24)10-4-8-17-12-14-21(15-13-17)19(23)11-5-9-16-6-2-1-3-7-16/h1-3,6-7,17,24H,4-5,8-15H2,(H,20,22)
InChIKeyCMFQOTKQZFPECE-UHFFFAOYSA-N
XLogP2.92
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.92
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-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide?
The IUPAC name of N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide (CID 87748028) is N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide.
What is the SMILES notation for N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide?
The canonical SMILES for N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide is O=C(CCCC1CCN(C(=O)CCCc2ccccc2)CC1)NO.
What is the InChIKey of N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide?
The InChIKey is CMFQOTKQZFPECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c22-18(20-24)10-4-8-17-12-14-21(15-13-17)19(23)11-5-9-16-6-2-1-3-7-16/h1-3,6-7,17,24H,4-5,8-15H2,(H,20,22).
What are the key properties of N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide?
N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide has a molecular weight of 332.44 g/mol, XLogP of 2.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[1-(4-phenylbutanoyl)piperidin-4-yl]butanamide is sourced from PubChem (CID 87748028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).