N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide

C15H20N2O2 — CID 22220544

IUPACN-[4-(4-oxopiperidin-1-yl)phenyl]butanamide
SMILESCCCC(=O)Nc1ccc(N2CCC(=O)CC2)cc1
InChIInChI=1S/C15H20N2O2/c1-2-3-15(19)16-12-4-6-13(7-5-12)17-10-8-14(18)9-11-17/h4-7H,2-3,8-11H2,1H3,(H,16,19)
InChIKeyRDVZSDNOEQLIFJ-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.59
Rot. Bonds4

About N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide

N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide (PubChem CID 22220544) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide.

Molecular Properties

Compound NameN-[4-(4-oxopiperidin-1-yl)phenyl]butanamide
PubChem CID22220544
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-[4-(4-oxopiperidin-1-yl)phenyl]butanamide
SMILESCCCC(=O)Nc1ccc(N2CCC(=O)CC2)cc1
InChIInChI=1S/C15H20N2O2/c1-2-3-15(19)16-12-4-6-13(7-5-12)17-10-8-14(18)9-11-17/h4-7H,2-3,8-11H2,1H3,(H,16,19)
InChIKeyRDVZSDNOEQLIFJ-UHFFFAOYSA-N
XLogP2.59
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-[4-(azepan-1-yl)phenyl]butanamide
CID 60593025
N-[4-(4-methoxypiperidin-1-yl)phenyl]butanamide
CID 90595801
N-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]butanamide
CID 113000164
N-(4-morpholin-4-ylphenyl)pentanamide
CID 2765048
N-[4-(butanoylamino)phenyl]butanamide;ethane
CID 166169399
N-[4-(4-benzylpiperidin-1-yl)phenyl]butanamide
CID 112985401
N-[4-(2,5-dioxopyrrol-1-yl)phenyl]butanamide
CID 69325577
3-chloro-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 43701399
3-(butylamino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 109012504
methyl 2-[4-[4-(butanoylamino)phenyl]piperazin-1-yl]-2-phenylacetate
CID 16666781
3-methylsulfanyl-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 18165019
3-[butyl(methyl)amino]-N-(4-piperidin-1-ylphenyl)propanamide
CID 108795373

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide?
The IUPAC name of N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide (CID 22220544) is N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide.
What is the SMILES notation for N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide?
The canonical SMILES for N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide is CCCC(=O)Nc1ccc(N2CCC(=O)CC2)cc1.
What is the InChIKey of N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide?
The InChIKey is RDVZSDNOEQLIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-2-3-15(19)16-12-4-6-13(7-5-12)17-10-8-14(18)9-11-17/h4-7H,2-3,8-11H2,1H3,(H,16,19).
What are the key properties of N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide?
N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide has a molecular weight of 260.34 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-oxopiperidin-1-yl)phenyl]butanamide is sourced from PubChem (CID 22220544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).