1-benzyl-4-(9H-fluoren-9-yl)piperazine

C24H24N2 — CID 118725827

IUPAC1-benzyl-4-(9H-fluoren-9-yl)piperazine
SMILESc1ccc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)cc1
InChIInChI=1S/C24H24N2/c1-2-8-19(9-3-1)18-25-14-16-26(17-15-25)24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h1-13,24H,14-18H2
InChIKeyDSMNMTIAUWKADX-UHFFFAOYSA-N
MW340.47 g/mol
LogP4.57
Rot. Bonds3

About 1-benzyl-4-(9H-fluoren-9-yl)piperazine

1-benzyl-4-(9H-fluoren-9-yl)piperazine (PubChem CID 118725827) has the molecular formula C24H24N2 and a molecular weight of 340.47 g/mol. Its IUPAC name is 1-benzyl-4-(9H-fluoren-9-yl)piperazine.

Molecular Properties

Compound Name1-benzyl-4-(9H-fluoren-9-yl)piperazine
PubChem CID118725827
Molecular FormulaC24H24N2
Molecular Weight340.47 g/mol
Exact Mass340.19
IUPAC Name1-benzyl-4-(9H-fluoren-9-yl)piperazine
SMILESc1ccc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)cc1
InChIInChI=1S/C24H24N2/c1-2-8-19(9-3-1)18-25-14-16-26(17-15-25)24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h1-13,24H,14-18H2
InChIKeyDSMNMTIAUWKADX-UHFFFAOYSA-N
XLogP4.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Cinnarizine
CID 1547484
Flunarizine
CID 941361
Hexafluorenium Bromide
CID 9434
Hexafluorenium
CID 3601
1-(Diphenylmethyl)-4-(3-phenylprop-2-enyl)piperazine
CID 2761
(E)-1-Benzhydryl-4-cinnamylpiperazine
CID 1615336
MT-45
CID 431865
Dimefadane
CID 21760
1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-1-methyl-5-phenyl-, (-)-
CID 3065151
1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-1-methyl-5-phenyl-, (+)-
CID 3065150
1-(9H-Fluoren-9-yl)piperazine
CID 410205
4-[6-Fluoro-3-(4-fluoro-phenyl)-indan-1-yl]-1,2,2-trimethyl-piperazine
CID 10522247

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-(9H-fluoren-9-yl)piperazine?
The IUPAC name of 1-benzyl-4-(9H-fluoren-9-yl)piperazine (CID 118725827) is 1-benzyl-4-(9H-fluoren-9-yl)piperazine.
What is the SMILES notation for 1-benzyl-4-(9H-fluoren-9-yl)piperazine?
The canonical SMILES for 1-benzyl-4-(9H-fluoren-9-yl)piperazine is c1ccc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)cc1.
What is the InChIKey of 1-benzyl-4-(9H-fluoren-9-yl)piperazine?
The InChIKey is DSMNMTIAUWKADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2/c1-2-8-19(9-3-1)18-25-14-16-26(17-15-25)24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h1-13,24H,14-18H2.
What are the key properties of 1-benzyl-4-(9H-fluoren-9-yl)piperazine?
1-benzyl-4-(9H-fluoren-9-yl)piperazine has a molecular weight of 340.47 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-(9H-fluoren-9-yl)piperazine is sourced from PubChem (CID 118725827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).