2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone

C24H24N2O — CID 1363911

IUPAC2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone
SMILESO=C(C(c1ccccc1)c1ccccc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C24H24N2O/c27-24(26-18-16-25(17-19-26)22-14-8-3-9-15-22)23(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,23H,16-19H2
InChIKeyHWSLJTVMHRPKDN-UHFFFAOYSA-N
MW356.47 g/mol
LogP4.17
Rot. Bonds4

About 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone

2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone (PubChem CID 1363911) has the molecular formula C24H24N2O and a molecular weight of 356.47 g/mol. Its IUPAC name is 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone
PubChem CID1363911
Molecular FormulaC24H24N2O
Molecular Weight356.47 g/mol
Exact Mass356.19
IUPAC Name2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone
SMILESO=C(C(c1ccccc1)c1ccccc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C24H24N2O/c27-24(26-18-16-25(17-19-26)22-14-8-3-9-15-22)23(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,23H,16-19H2
InChIKeyHWSLJTVMHRPKDN-UHFFFAOYSA-N
XLogP4.17
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone?
The IUPAC name of 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone (CID 1363911) is 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone?
The canonical SMILES for 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone is O=C(C(c1ccccc1)c1ccccc1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone?
The InChIKey is HWSLJTVMHRPKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O/c27-24(26-18-16-25(17-19-26)22-14-8-3-9-15-22)23(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,23H,16-19H2.
What are the key properties of 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone?
2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone has a molecular weight of 356.47 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-1-(4-phenylpiperazin-1-yl)ethanone is sourced from PubChem (CID 1363911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).