N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide

C20H24ClN3O — CID 60504794

IUPACN-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
SMILESCc1cccc(N2CCN(CCC(=O)Nc3ccc(Cl)cc3)CC2)c1
InChIInChI=1S/C20H24ClN3O/c1-16-3-2-4-19(15-16)24-13-11-23(12-14-24)10-9-20(25)22-18-7-5-17(21)6-8-18/h2-8,15H,9-14H2,1H3,(H,22,25)
InChIKeyZHQJVNWMMBKXMW-UHFFFAOYSA-N
MW357.89 g/mol
LogP3.80
Rot. Bonds5

About N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide

N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide (PubChem CID 60504794) has the molecular formula C20H24ClN3O and a molecular weight of 357.89 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
PubChem CID60504794
Molecular FormulaC20H24ClN3O
Molecular Weight357.89 g/mol
Exact Mass357.16
IUPAC NameN-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
SMILESCc1cccc(N2CCN(CCC(=O)Nc3ccc(Cl)cc3)CC2)c1
InChIInChI=1S/C20H24ClN3O/c1-16-3-2-4-19(15-16)24-13-11-23(12-14-24)10-9-20(25)22-18-7-5-17(21)6-8-18/h2-8,15H,9-14H2,1H3,(H,22,25)
InChIKeyZHQJVNWMMBKXMW-UHFFFAOYSA-N
XLogP3.80
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.89
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(3,4-dichlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 109029431
3-[4-(4-chlorophenyl)piperazin-1-yl]-N-(3-methylphenyl)propanamide
CID 42858886
N-(4-ethoxyphenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 109029408
N-(6-amino-3-pyridinyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 119516064
N-(3-methoxyphenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 109029405
N-(4-methylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661863
N-(5-methyl-1,2-oxazol-3-yl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 35799420
2-(4-chlorophenyl)-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]acetamide
CID 38440949
N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661841
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 6466210
3-[4-(3-methylphenyl)piperazin-1-yl]propanoic acid;dihydrochloride
CID 43810604
N-benzyl-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 109018781

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide?
The IUPAC name of N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide (CID 60504794) is N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide is Cc1cccc(N2CCN(CCC(=O)Nc3ccc(Cl)cc3)CC2)c1.
What is the InChIKey of N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide?
The InChIKey is ZHQJVNWMMBKXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClN3O/c1-16-3-2-4-19(15-16)24-13-11-23(12-14-24)10-9-20(25)22-18-7-5-17(21)6-8-18/h2-8,15H,9-14H2,1H3,(H,22,25).
What are the key properties of N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide?
N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide has a molecular weight of 357.89 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 60504794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).