3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide

C19H21ClFN3O — CID 120757256

IUPAC3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide
SMILESO=C(CCN1CCNCC1c1ccccc1Cl)Nc1ccccc1F
InChIInChI=1S/C19H21ClFN3O/c20-15-6-2-1-5-14(15)18-13-22-10-12-24(18)11-9-19(25)23-17-8-4-3-7-16(17)21/h1-8,18,22H,9-13H2,(H,23,25)
InChIKeyABASINQEZBIJJG-UHFFFAOYSA-N
MW361.85 g/mol
LogP3.45
Rot. Bonds5

About 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide

3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide (PubChem CID 120757256) has the molecular formula C19H21ClFN3O and a molecular weight of 361.85 g/mol. Its IUPAC name is 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide.

Molecular Properties

Compound Name3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide
PubChem CID120757256
Molecular FormulaC19H21ClFN3O
Molecular Weight361.85 g/mol
Exact Mass361.14
IUPAC Name3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide
SMILESO=C(CCN1CCNCC1c1ccccc1Cl)Nc1ccccc1F
InChIInChI=1S/C19H21ClFN3O/c20-15-6-2-1-5-14(15)18-13-22-10-12-24(18)11-9-19(25)23-17-8-4-3-7-16(17)21/h1-8,18,22H,9-13H2,(H,23,25)
InChIKeyABASINQEZBIJJG-UHFFFAOYSA-N
XLogP3.45
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.85
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)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-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide
CID 120757424
2-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 120757638
2-[2-(2-chlorophenyl)piperazin-1-yl]-N-propan-2-ylacetamide
CID 120757474
N-(2-chlorophenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
CID 120754125
N-benzyl-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide
CID 120757524
2-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 120757432
N-[(2-chlorophenyl)methyl]-3-[2-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 120753162
N-[4-[[2-(2-chlorophenyl)piperazin-1-yl]methyl]phenyl]acetamide;hydrochloride
CID 120768769
N-(2,5-dichlorophenyl)-3-(2-pyridin-3-ylpiperazin-1-yl)propanamide
CID 120754693
2-(2-chlorophenyl)-1-(2-ethylsulfonylethyl)piperazine;hydrochloride
CID 120757517
2-[2-(2-chlorophenyl)piperazin-1-yl]-N,N-di(propan-2-yl)acetamide
CID 120757480
N-(2-fluorophenyl)-3-(2-formylpiperidin-1-yl)propanamide
CID 62654769

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide?
The IUPAC name of 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide (CID 120757256) is 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide.
What is the SMILES notation for 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide?
The canonical SMILES for 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide is O=C(CCN1CCNCC1c1ccccc1Cl)Nc1ccccc1F.
What is the InChIKey of 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide?
The InChIKey is ABASINQEZBIJJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClFN3O/c20-15-6-2-1-5-14(15)18-13-22-10-12-24(18)11-9-19(25)23-17-8-4-3-7-16(17)21/h1-8,18,22H,9-13H2,(H,23,25).
What are the key properties of 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide?
3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide has a molecular weight of 361.85 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide is sourced from PubChem (CID 120757256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).