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

C20H23ClN4O2 — CID 120757424

IUPACN-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2CCNCC2c2ccccc2Cl)cc1
InChIInChI=1S/C20H23ClN4O2/c1-14(26)23-15-6-8-16(9-7-15)24-20(27)13-25-11-10-22-12-19(25)17-4-2-3-5-18(17)21/h2-9,19,22H,10-13H2,1H3,(H,23,26)(H,24,27)
InChIKeyQPRVMOCDDFQDCA-UHFFFAOYSA-N
MW386.88 g/mol
LogP2.88
Rot. Bonds5

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

N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide (PubChem CID 120757424) has the molecular formula C20H23ClN4O2 and a molecular weight of 386.88 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide
PubChem CID120757424
Molecular FormulaC20H23ClN4O2
Molecular Weight386.88 g/mol
Exact Mass386.15
IUPAC NameN-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2CCNCC2c2ccccc2Cl)cc1
InChIInChI=1S/C20H23ClN4O2/c1-14(26)23-15-6-8-16(9-7-15)24-20(27)13-25-11-10-22-12-19(25)17-4-2-3-5-18(17)21/h2-9,19,22H,10-13H2,1H3,(H,23,26)(H,24,27)
InChIKeyQPRVMOCDDFQDCA-UHFFFAOYSA-N
XLogP2.88
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.88
LogP ≤ 52.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide (CID 120757424) is N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide is CC(=O)Nc1ccc(NC(=O)CN2CCNCC2c2ccccc2Cl)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide?
The InChIKey is QPRVMOCDDFQDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O2/c1-14(26)23-15-6-8-16(9-7-15)24-20(27)13-25-11-10-22-12-19(25)17-4-2-3-5-18(17)21/h2-9,19,22H,10-13H2,1H3,(H,23,26)(H,24,27).
What are the key properties of N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide?
N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide has a molecular weight of 386.88 g/mol, XLogP of 2.88, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[2-(2-chlorophenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 120757424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).