N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide

C22H27N3O2 — CID 70630292

IUPACN-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCN(C(=O)C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C22H27N3O2/c1-18(26)23-12-13-24-14-16-25(17-15-24)22(27)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,21H,12-17H2,1H3,(H,23,26)
InChIKeyHDBXYGHQXKTGRO-UHFFFAOYSA-N
MW365.48 g/mol
LogP2.10
Rot. Bonds6

About N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide

N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide (PubChem CID 70630292) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide
PubChem CID70630292
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCN(C(=O)C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C22H27N3O2/c1-18(26)23-12-13-24-14-16-25(17-15-24)22(27)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,21H,12-17H2,1H3,(H,23,26)
InChIKeyHDBXYGHQXKTGRO-UHFFFAOYSA-N
XLogP2.10
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-diphenyl-1-(4-propylpiperazin-1-yl)ethanone
CID 11232518
N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]-4-fluorobenzamide
CID 29200300
1-(4-ethylpiperazin-1-yl)-2,2-diphenylethanone
CID 2303179
1-[4-(2-methylsulfonylethyl)piperazin-1-yl]-2,2-diphenylethanone
CID 95753443
1-[4-(2,2-diphenylacetyl)-1,4-diazepan-1-yl]-2,2-diphenylethanone
CID 5069183
2-acetyl-N-[2-(4-acetylpiperazin-1-yl)ethyl]benzamide
CID 71871594
methyl 4-(2,2-diphenylacetyl)piperazine-1-carboxylate
CID 110818280
2,2-diphenyl-1-[4-(2-pyrazol-1-ylethyl)piperazin-1-yl]ethanone
CID 90508606
4-fluoro-N-[2-[4-(2-phenylbutanoyl)piperazin-1-yl]ethyl]benzamide
CID 44962537
1-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-2,2-diphenylethanone
CID 110395727
1-[4-[(2R)-3-chloro-2-hydroxypropyl]piperazin-1-yl]-2,2-diphenylethanone
CID 139637301
2,2-diphenyl-1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]ethanone
CID 2838766

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide (CID 70630292) is N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide is CC(=O)NCCN1CCN(C(=O)C(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide?
The InChIKey is HDBXYGHQXKTGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-18(26)23-12-13-24-14-16-25(17-15-24)22(27)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,21H,12-17H2,1H3,(H,23,26).
What are the key properties of N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide?
N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide has a molecular weight of 365.48 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2,2-diphenylacetyl)piperazin-1-yl]ethyl]acetamide is sourced from PubChem (CID 70630292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).