1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine

C15H21FN2O2S — CID 45369149

IUPAC1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine
SMILESO=S(=O)(c1ccccc1F)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H21FN2O2S/c16-14-7-3-4-8-15(14)21(19,20)18-11-9-17(10-12-18)13-5-1-2-6-13/h3-4,7-8,13H,1-2,5-6,9-12H2
InChIKeyGBEZTIUQTPDERE-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.07
Rot. Bonds3

About 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine

1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine (PubChem CID 45369149) has the molecular formula C15H21FN2O2S and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine.

Molecular Properties

Compound Name1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine
PubChem CID45369149
Molecular FormulaC15H21FN2O2S
Molecular Weight312.41 g/mol
Exact Mass312.13
IUPAC Name1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine
SMILESO=S(=O)(c1ccccc1F)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H21FN2O2S/c16-14-7-3-4-8-15(14)21(19,20)18-11-9-17(10-12-18)13-5-1-2-6-13/h3-4,7-8,13H,1-2,5-6,9-12H2
InChIKeyGBEZTIUQTPDERE-UHFFFAOYSA-N
XLogP2.07
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluorophenyl)sulfonyl-4-pyrrolidin-1-ylpiperidine
CID 51892276
1-(2-fluorophenyl)sulfonyl-3-pyrrolidin-1-ylpiperidine
CID 61046286
1-(2-chlorophenyl)sulfonyl-4-cyclopropylpiperazine
CID 47454432
2-(4-cyclopropylpiperazin-1-yl)sulfonylphenol
CID 81241270
(4aS,8aS)-2-(2-fluorophenyl)sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline
CID 11926572
1-(cyclopropylmethyl)-4-(2-fluorophenyl)sulfonylpiperazine
CID 61046329
1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine
CID 11949879
1-(4-bromo-2-fluorophenyl)sulfonyl-4-cyclopropylpiperazine
CID 116528277
1-(2-fluorophenyl)sulfonyl-2,3,3a,4,5,6,7,7a-octahydroindole
CID 78989322
3-(4-cyclohexylpiperazin-1-yl)sulfonyl-1H-indole
CID 175632553
2-cyclohexyl-1-(2-fluorophenyl)sulfonylpyrrolidine
CID 61045786
[2-(4-cyclopropylpiperazin-1-yl)sulfonylphenyl]hydrazine
CID 61442784

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine?
The IUPAC name of 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine (CID 45369149) is 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine.
What is the SMILES notation for 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine?
The canonical SMILES for 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine is O=S(=O)(c1ccccc1F)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine?
The InChIKey is GBEZTIUQTPDERE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2S/c16-14-7-3-4-8-15(14)21(19,20)18-11-9-17(10-12-18)13-5-1-2-6-13/h3-4,7-8,13H,1-2,5-6,9-12H2.
What are the key properties of 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine?
1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine has a molecular weight of 312.41 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine is sourced from PubChem (CID 45369149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).