1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine

C22H26N2 — CID 171282564

IUPAC1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine
SMILESc1ccc2c(c1)Cc1cc([C@H](CC3CC3)N3CCNCC3)ccc1-2
InChIInChI=1S/C22H26N2/c1-2-4-20-17(3-1)14-19-15-18(7-8-21(19)20)22(13-16-5-6-16)24-11-9-23-10-12-24/h1-4,7-8,15-16,22-23H,5-6,9-14H2/t22-/m0/s1
InChIKeyDCWHZOBVJIKERQ-QFIPXVFZSA-N
MW318.46 g/mol
LogP4.00
Rot. Bonds4

About 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine

1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine (PubChem CID 171282564) has the molecular formula C22H26N2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine
PubChem CID171282564
Molecular FormulaC22H26N2
Molecular Weight318.46 g/mol
Exact Mass318.21
IUPAC Name1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine
SMILESc1ccc2c(c1)Cc1cc([C@H](CC3CC3)N3CCNCC3)ccc1-2
InChIInChI=1S/C22H26N2/c1-2-4-20-17(3-1)14-19-15-18(7-8-21(19)20)22(13-16-5-6-16)24-11-9-23-10-12-24/h1-4,7-8,15-16,22-23H,5-6,9-14H2/t22-/m0/s1
InChIKeyDCWHZOBVJIKERQ-QFIPXVFZSA-N
XLogP4.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1R)-1-(9H-fluoren-2-yl)-4,4,4-trifluorobutyl]piperazine;hydrochloride
CID 171172658
1-[(1S)-1-(9H-fluoren-2-yl)-3,3,3-trifluoropropyl]piperazine;hydrochloride
CID 171167242
(3S)-3-(9H-fluoren-2-yl)-3-piperazin-1-ylpropanenitrile;dihydrochloride
CID 171306357
1-[(1R)-1-(9H-fluoren-2-yl)hexyl]piperazine
CID 171308299
1-[(R)-cyclohexyl(9H-fluoren-2-yl)methyl]piperazine;dihydrochloride
CID 171295175
1-[(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethyl]piperazine
CID 171292165
1-[(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethyl]piperazine;dihydrochloride
CID 171292166
1-[(1S)-1-(9H-fluoren-2-yl)-2,2,2-trifluoroethyl]piperazine;dihydrochloride
CID 171295162
1-[(1R)-2-cyclopropyl-1-(4-iodophenyl)ethyl]piperazine
CID 171288681
1-[(1R)-1-(3-chloro-4-methylphenyl)-2-cyclopropylethyl]piperazine
CID 171289842
1-[(1S)-2-cyclopropyl-1-(4-fluorophenyl)ethyl]piperazine;dihydrochloride
CID 171273249
1-[(1R)-2-cyclopropyl-1-(4-iodophenyl)ethyl]piperazine;dihydrochloride
CID 171288682

Frequently Asked Questions

What is the IUPAC name of 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine?
The IUPAC name of 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine (CID 171282564) is 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine.
What is the SMILES notation for 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine?
The canonical SMILES for 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine is c1ccc2c(c1)Cc1cc([C@H](CC3CC3)N3CCNCC3)ccc1-2.
What is the InChIKey of 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine?
The InChIKey is DCWHZOBVJIKERQ-QFIPXVFZSA-N. The full InChI is InChI=1S/C22H26N2/c1-2-4-20-17(3-1)14-19-15-18(7-8-21(19)20)22(13-16-5-6-16)24-11-9-23-10-12-24/h1-4,7-8,15-16,22-23H,5-6,9-14H2/t22-/m0/s1.
What are the key properties of 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine?
1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine has a molecular weight of 318.46 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S)-2-cyclopropyl-1-(9H-fluoren-2-yl)ethyl]piperazine is sourced from PubChem (CID 171282564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).