1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine

C23H30N2 — CID 171308299

IUPAC1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine
SMILESCCCCC[C@H](c1ccc2c(c1)Cc1ccccc1-2)N1CCNCC1
InChIInChI=1S/C23H30N2/c1-2-3-4-9-23(25-14-12-24-13-15-25)19-10-11-22-20(17-19)16-18-7-5-6-8-21(18)22/h5-8,10-11,17,23-24H,2-4,9,12-16H2,1H3/t23-/m1/s1
InChIKeyNOYBQFDJLAXIOD-HSZRJFAPSA-N
MW334.51 g/mol
LogP4.78
Rot. Bonds6

About 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine

1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine (PubChem CID 171308299) has the molecular formula C23H30N2 and a molecular weight of 334.51 g/mol. Its IUPAC name is 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine
PubChem CID171308299
Molecular FormulaC23H30N2
Molecular Weight334.51 g/mol
Exact Mass334.24
IUPAC Name1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine
SMILESCCCCC[C@H](c1ccc2c(c1)Cc1ccccc1-2)N1CCNCC1
InChIInChI=1S/C23H30N2/c1-2-3-4-9-23(25-14-12-24-13-15-25)19-10-11-22-20(17-19)16-18-7-5-6-8-21(18)22/h5-8,10-11,17,23-24H,2-4,9,12-16H2,1H3/t23-/m1/s1
InChIKeyNOYBQFDJLAXIOD-HSZRJFAPSA-N
XLogP4.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.51
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[(1R)-1-(9H-fluoren-2-yl)-4,4,4-trifluorobutyl]piperazine;hydrochloride
CID 171172658
1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine
CID 171282564
(3S)-3-(9H-fluoren-2-yl)-3-piperazin-1-ylpropanenitrile;dihydrochloride
CID 171306357
1-[(1S)-1-(9H-fluoren-2-yl)-3,3,3-trifluoropropyl]piperazine;hydrochloride
CID 171167242
1-[(1S)-1-(4-phenoxyphenyl)hexyl]piperazine
CID 171309305
1-[(1R)-1-(3-phenylphenyl)hexyl]piperazine
CID 171308361
1-[(1S)-1-(3,4-dibromophenyl)hexyl]piperazine
CID 171309713
4-[(1R)-1-piperazin-1-ylhexyl]benzene-1,2-diol
CID 171307270
1-[(1S)-1-(3,4-difluorophenyl)hexyl]piperazine
CID 171166603
1-[(1R)-1-(4-phenoxyphenyl)hexyl]piperazine;dihydrochloride
CID 171308008
1-[(1R)-1-(3-phenylphenyl)hexyl]piperazine;dihydrochloride
CID 171308362
1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride
CID 171307529

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine?
The IUPAC name of 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine (CID 171308299) is 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine.
What is the SMILES notation for 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine?
The canonical SMILES for 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine is CCCCC[C@H](c1ccc2c(c1)Cc1ccccc1-2)N1CCNCC1.
What is the InChIKey of 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine?
The InChIKey is NOYBQFDJLAXIOD-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H30N2/c1-2-3-4-9-23(25-14-12-24-13-15-25)19-10-11-22-20(17-19)16-18-7-5-6-8-21(18)22/h5-8,10-11,17,23-24H,2-4,9,12-16H2,1H3/t23-/m1/s1.
What are the key properties of 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine?
1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine has a molecular weight of 334.51 g/mol, XLogP of 4.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine is sourced from PubChem (CID 171308299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).