2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone

C25H24N2O — CID 2814694

IUPAC2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone
SMILESO=C(CN1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccccc1
InChIInChI=1S/C25H24N2O/c28-24(19-8-2-1-3-9-19)18-26-14-16-27(17-15-26)25-22-12-6-4-10-20(22)21-11-5-7-13-23(21)25/h1-13,25H,14-18H2
InChIKeyFIGOAKPKPKMJRK-UHFFFAOYSA-N
MW368.48 g/mol
LogP4.26
Rot. Bonds4

About 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone

2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone (PubChem CID 2814694) has the molecular formula C25H24N2O and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone.

Molecular Properties

Compound Name2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone
PubChem CID2814694
Molecular FormulaC25H24N2O
Molecular Weight368.48 g/mol
Exact Mass368.19
IUPAC Name2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone
SMILESO=C(CN1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccccc1
InChIInChI=1S/C25H24N2O/c28-24(19-8-2-1-3-9-19)18-26-14-16-27(17-15-26)25-22-12-6-4-10-20(22)21-11-5-7-13-23(21)25/h1-13,25H,14-18H2
InChIKeyFIGOAKPKPKMJRK-UHFFFAOYSA-N
XLogP4.26
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[4-(9H-fluoren-9-yl)piperazin-1-yl]ethanone
CID 2815524
2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-N-methylacetamide
CID 8774574
2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-(2-methoxyphenyl)ethanone
CID 4226169
1-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)piperazin-1-yl]ethanone
CID 4226165
2-(4-benzoylpiperazin-1-yl)-1-phenylethanone
CID 3599210
2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-N-(2-methylsulfanylphenyl)acetamide
CID 72550463
2-[4-(oxiran-2-yl)piperidin-1-yl]-1-phenylethanone
CID 59305185
2-(4-benzhydrylpiperazin-1-yl)-1-phenylethanone
CID 10339151
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-1-phenylethanone
CID 110366202
2-(4-benzhydrylidenepiperidin-1-yl)-1-phenylethanone
CID 110183664
1-phenyl-2-(3-sulfanylazetidin-1-yl)ethanone
CID 18792641
2-(9H-fluoren-9-yl)-2,2-difluoro-1-phenylethanone
CID 156695088

Frequently Asked Questions

What is the IUPAC name of 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone?
The IUPAC name of 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone (CID 2814694) is 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone.
What is the SMILES notation for 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone?
The canonical SMILES for 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone is O=C(CN1CCN(C2c3ccccc3-c3ccccc32)CC1)c1ccccc1.
What is the InChIKey of 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone?
The InChIKey is FIGOAKPKPKMJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O/c28-24(19-8-2-1-3-9-19)18-26-14-16-27(17-15-26)25-22-12-6-4-10-20(22)21-11-5-7-13-23(21)25/h1-13,25H,14-18H2.
What are the key properties of 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone?
2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone has a molecular weight of 368.48 g/mol, XLogP of 4.26, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-phenylethanone is sourced from PubChem (CID 2814694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).