4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide

C19H20ClN3O2 — CID 55560081

IUPAC4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C19H20ClN3O2/c1-14-2-8-17(9-3-14)21-19(25)23-12-10-22(11-13-23)18(24)15-4-6-16(20)7-5-15/h2-9H,10-13H2,1H3,(H,21,25)
InChIKeyUZTOAOYYTFDCGI-UHFFFAOYSA-N
MW357.84 g/mol
LogP3.64
Rot. Bonds2

About 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide

4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide (PubChem CID 55560081) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide
PubChem CID55560081
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C19H20ClN3O2/c1-14-2-8-17(9-3-14)21-19(25)23-12-10-22(11-13-23)18(24)15-4-6-16(20)7-5-15/h2-9H,10-13H2,1H3,(H,21,25)
InChIKeyUZTOAOYYTFDCGI-UHFFFAOYSA-N
XLogP3.64
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide 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

1-N,4-N-bis(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 4055899
N-(4-chlorophenyl)-4-(3-fluoro-4-methylbenzoyl)piperazine-1-carboxamide
CID 47049586
N-(4-chlorophenyl)-4-(4-methylbenzoyl)piperidine-1-carboxamide
CID 55874085
4-[2-(4-chlorophenyl)ethyl]-N-(4-methylphenyl)piperazine-1-carboxamide
CID 113109898
1-N-methyl-4-N-(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 23990210
4-[4-[(4-chlorobenzoyl)amino]-2-(piperidine-1-carbonyl)phenyl]-N-(4-methylphenyl)piperazine-1-carboxamide
CID 42678890
4-(4-fluorobenzoyl)-N-[4-(4-methylphenoxy)phenyl]-1,4-diazepane-1-carboxamide
CID 112824763
N-[[4-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]carbamothioyl]-4-methylbenzamide
CID 3917677
N-[4-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]acetamide
CID 2994878
N-(4-chlorophenyl)-4-(3,5-dimethylphenyl)piperazine-1-carboxamide
CID 113111729
N-(4-chlorophenyl)-4-(3-methylfuran-2-carbonyl)piperazine-1-carboxamide
CID 75370481
[4-(3,5-dichlorobenzoyl)piperazin-1-yl]-(4-methylphenyl)methanone
CID 110495911

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide?
The IUPAC name of 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide (CID 55560081) is 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide is Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1.
What is the InChIKey of 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide?
The InChIKey is UZTOAOYYTFDCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c1-14-2-8-17(9-3-14)21-19(25)23-12-10-22(11-13-23)18(24)15-4-6-16(20)7-5-15/h2-9H,10-13H2,1H3,(H,21,25).
What are the key properties of 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide?
4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide has a molecular weight of 357.84 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorobenzoyl)-N-(4-methylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 55560081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).