N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide

C20H23ClN4O2 — CID 2685330

IUPACN-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2CCN(c3cccc(Cl)c3)CC2)cc1
InChIInChI=1S/C20H23ClN4O2/c1-15(26)22-17-5-7-18(8-6-17)23-20(27)14-24-9-11-25(12-10-24)19-4-2-3-16(21)13-19/h2-8,13H,9-12,14H2,1H3,(H,22,26)(H,23,27)
InChIKeyAPARPUPVNDCABJ-UHFFFAOYSA-N
MW386.88 g/mol
LogP3.06
Rot. Bonds5

About N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide

N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide (PubChem CID 2685330) has the molecular formula C20H23ClN4O2 and a molecular weight of 386.88 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide
PubChem CID2685330
Molecular FormulaC20H23ClN4O2
Molecular Weight386.88 g/mol
Exact Mass386.15
IUPAC NameN-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2CCN(c3cccc(Cl)c3)CC2)cc1
InChIInChI=1S/C20H23ClN4O2/c1-15(26)22-17-5-7-18(8-6-17)23-20(27)14-24-9-11-25(12-10-24)19-4-2-3-16(21)13-19/h2-8,13H,9-12,14H2,1H3,(H,22,26)(H,23,27)
InChIKeyAPARPUPVNDCABJ-UHFFFAOYSA-N
XLogP3.06
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.88
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(3-chlorophenyl)piperazin-1-yl]-N-phenylacetamide
CID 6467969
N-(4-acetamidophenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 41312804
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-nitrophenyl)acetamide
CID 8530335
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide
CID 4238150
1-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-one
CID 60649957
4-[[2-[4-(3-chlorophenyl)piperazin-1-yl]acetyl]amino]-N-(4-ethoxyphenyl)benzamide
CID 27157023
N-[4-[4-(3-chlorophenyl)piperazin-1-yl]phenyl]propanamide
CID 112984512
2-[4-(3-chlorophenyl)piperazin-1-yl]acetohydrazide
CID 12578869
N-(5-chloro-2-fluorophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide
CID 8530050
N-(4-acetylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide
CID 1448514
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide
CID 2453681
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2,5-difluorophenyl)acetamide
CID 3472016

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide (CID 2685330) is N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide is CC(=O)Nc1ccc(NC(=O)CN2CCN(c3cccc(Cl)c3)CC2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide?
The InChIKey is APARPUPVNDCABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O2/c1-15(26)22-17-5-7-18(8-6-17)23-20(27)14-24-9-11-25(12-10-24)19-4-2-3-16(21)13-19/h2-8,13H,9-12,14H2,1H3,(H,22,26)(H,23,27).
What are the key properties of N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide?
N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide has a molecular weight of 386.88 g/mol, XLogP of 3.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 2685330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).