N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide

C20H25N3O — CID 10496165

IUPACN,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide
SMILESCN(C)C(=O)c1ccc(C(c2ccccc2)N2CCNCC2)cc1
InChIInChI=1S/C20H25N3O/c1-22(2)20(24)18-10-8-17(9-11-18)19(16-6-4-3-5-7-16)23-14-12-21-13-15-23/h3-11,19,21H,12-15H2,1-2H3
InChIKeyONJFFIROJUYRLZ-UHFFFAOYSA-N
MW323.44 g/mol
LogP2.38
Rot. Bonds4

About N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide

N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide (PubChem CID 10496165) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide
PubChem CID10496165
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide
SMILESCN(C)C(=O)c1ccc(C(c2ccccc2)N2CCNCC2)cc1
InChIInChI=1S/C20H25N3O/c1-22(2)20(24)18-10-8-17(9-11-18)19(16-6-4-3-5-7-16)23-14-12-21-13-15-23/h3-11,19,21H,12-15H2,1-2H3
InChIKeyONJFFIROJUYRLZ-UHFFFAOYSA-N
XLogP2.38
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide 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 N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide?
The IUPAC name of N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide (CID 10496165) is N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide is CN(C)C(=O)c1ccc(C(c2ccccc2)N2CCNCC2)cc1.
What is the InChIKey of N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide?
The InChIKey is ONJFFIROJUYRLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-22(2)20(24)18-10-8-17(9-11-18)19(16-6-4-3-5-7-16)23-14-12-21-13-15-23/h3-11,19,21H,12-15H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide?
N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide has a molecular weight of 323.44 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[phenyl(piperazin-1-yl)methyl]benzamide is sourced from PubChem (CID 10496165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).