N-(4-piperidin-1-ylphenyl)benzamide

C18H20N2O — CID 732495

IUPACN-(4-piperidin-1-ylphenyl)benzamide
SMILESO=C(Nc1ccc(N2CCCCC2)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O/c21-18(15-7-3-1-4-8-15)19-16-9-11-17(12-10-16)20-13-5-2-6-14-20/h1,3-4,7-12H,2,5-6,13-14H2,(H,19,21)
InChIKeyYLOKWKMPODCMBQ-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.93
Rot. Bonds3

About N-(4-piperidin-1-ylphenyl)benzamide

N-(4-piperidin-1-ylphenyl)benzamide (PubChem CID 732495) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(4-piperidin-1-ylphenyl)benzamide.

Molecular Properties

Compound NameN-(4-piperidin-1-ylphenyl)benzamide
PubChem CID732495
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(4-piperidin-1-ylphenyl)benzamide
SMILESO=C(Nc1ccc(N2CCCCC2)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O/c21-18(15-7-3-1-4-8-15)19-16-9-11-17(12-10-16)20-13-5-2-6-14-20/h1,3-4,7-12H,2,5-6,13-14H2,(H,19,21)
InChIKeyYLOKWKMPODCMBQ-UHFFFAOYSA-N
XLogP3.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-piperidin-1-ylphenyl)benzamide?
The IUPAC name of N-(4-piperidin-1-ylphenyl)benzamide (CID 732495) is N-(4-piperidin-1-ylphenyl)benzamide.
What is the SMILES notation for N-(4-piperidin-1-ylphenyl)benzamide?
The canonical SMILES for N-(4-piperidin-1-ylphenyl)benzamide is O=C(Nc1ccc(N2CCCCC2)cc1)c1ccccc1.
What is the InChIKey of N-(4-piperidin-1-ylphenyl)benzamide?
The InChIKey is YLOKWKMPODCMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c21-18(15-7-3-1-4-8-15)19-16-9-11-17(12-10-16)20-13-5-2-6-14-20/h1,3-4,7-12H,2,5-6,13-14H2,(H,19,21).
What are the key properties of N-(4-piperidin-1-ylphenyl)benzamide?
N-(4-piperidin-1-ylphenyl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-piperidin-1-ylphenyl)benzamide is sourced from PubChem (CID 732495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).