2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide

C21H26N2O — CID 52914887

IUPAC2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide
SMILESCCC(C(=O)Nc1ccccc1N1CCCCC1)c1ccccc1
InChIInChI=1S/C21H26N2O/c1-2-18(17-11-5-3-6-12-17)21(24)22-19-13-7-8-14-20(19)23-15-9-4-10-16-23/h3,5-8,11-14,18H,2,4,9-10,15-16H2,1H3,(H,22,24)
InChIKeyLLWHJHOWUMAHCG-UHFFFAOYSA-N
MW322.45 g/mol
LogP4.81
Rot. Bonds5

About 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide

2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide (PubChem CID 52914887) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide.

Molecular Properties

Compound Name2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide
PubChem CID52914887
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide
SMILESCCC(C(=O)Nc1ccccc1N1CCCCC1)c1ccccc1
InChIInChI=1S/C21H26N2O/c1-2-18(17-11-5-3-6-12-17)21(24)22-19-13-7-8-14-20(19)23-15-9-4-10-16-23/h3,5-8,11-14,18H,2,4,9-10,15-16H2,1H3,(H,22,24)
InChIKeyLLWHJHOWUMAHCG-UHFFFAOYSA-N
XLogP4.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide?
The IUPAC name of 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide (CID 52914887) is 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide.
What is the SMILES notation for 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide?
The canonical SMILES for 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide is CCC(C(=O)Nc1ccccc1N1CCCCC1)c1ccccc1.
What is the InChIKey of 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide?
The InChIKey is LLWHJHOWUMAHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-2-18(17-11-5-3-6-12-17)21(24)22-19-13-7-8-14-20(19)23-15-9-4-10-16-23/h3,5-8,11-14,18H,2,4,9-10,15-16H2,1H3,(H,22,24).
What are the key properties of 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide?
2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide has a molecular weight of 322.45 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(2-piperidin-1-ylphenyl)butanamide is sourced from PubChem (CID 52914887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).