N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide

C19H22ClN3O — CID 18078421

IUPACN-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide
SMILESCC(C(=O)Nc1ccc(Cl)cc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H22ClN3O/c1-15(19(24)21-17-9-7-16(20)8-10-17)22-11-13-23(14-12-22)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,21,24)
InChIKeyJDROHVSLGDLUIY-UHFFFAOYSA-N
MW343.86 g/mol
LogP3.49
Rot. Bonds4

About N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide

N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide (PubChem CID 18078421) has the molecular formula C19H22ClN3O and a molecular weight of 343.86 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide
PubChem CID18078421
Molecular FormulaC19H22ClN3O
Molecular Weight343.86 g/mol
Exact Mass343.15
IUPAC NameN-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide
SMILESCC(C(=O)Nc1ccc(Cl)cc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H22ClN3O/c1-15(19(24)21-17-9-7-16(20)8-10-17)22-11-13-23(14-12-22)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,21,24)
InChIKeyJDROHVSLGDLUIY-UHFFFAOYSA-N
XLogP3.49
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.86
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-chlorophenyl)-2-(4-phenylpiperazin-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

(2S)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-phenylpropanamide
CID 40729619
2-(4-phenylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 42911835
2-(4-benzoylpiperazin-1-yl)-N-(4-chlorophenyl)propanamide
CID 18082984
(2S)-N-(5-chloro-2-pyridinyl)-2-(4-phenylpiperazin-1-yl)propanamide
CID 25340743
(2S)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-chlorophenyl)propanamide
CID 8512070
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 46744278
(2S)-2-(4-phenylpiperazin-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 9250174
(2S)-N-(3,5-dichlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 2096596
2-[4-(2-chlorophenyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide
CID 42858816
(2S)-N-(3-chlorophenyl)-2-[4-(4-methylphenyl)piperazin-1-yl]propanamide
CID 92987466
N-(4-bromophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 4264771
(2S)-N-(4-bromophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 2096677

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide?
The IUPAC name of N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide (CID 18078421) is N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide is CC(C(=O)Nc1ccc(Cl)cc1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide?
The InChIKey is JDROHVSLGDLUIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O/c1-15(19(24)21-17-9-7-16(20)8-10-17)22-11-13-23(14-12-22)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,21,24).
What are the key properties of N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide?
N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide has a molecular weight of 343.86 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(4-phenylpiperazin-1-yl)propanamide is sourced from PubChem (CID 18078421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).