1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine

C14H22N2O2S2 — CID 110708935

IUPAC1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine
SMILESCc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)s1
InChIInChI=1S/C14H22N2O2S2/c1-12-6-7-14(19-12)20(17,18)16-10-8-15(9-11-16)13-4-2-3-5-13/h6-7,13H,2-5,8-11H2,1H3
InChIKeyJOUPKKLPIYTSDI-UHFFFAOYSA-N
MW314.48 g/mol
LogP2.31
Rot. Bonds3

About 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine

1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine (PubChem CID 110708935) has the molecular formula C14H22N2O2S2 and a molecular weight of 314.48 g/mol. Its IUPAC name is 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine.

Molecular Properties

Compound Name1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine
PubChem CID110708935
Molecular FormulaC14H22N2O2S2
Molecular Weight314.48 g/mol
Exact Mass314.11
IUPAC Name1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine
SMILESCc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)s1
InChIInChI=1S/C14H22N2O2S2/c1-12-6-7-14(19-12)20(17,18)16-10-8-15(9-11-16)13-4-2-3-5-13/h6-7,13H,2-5,8-11H2,1H3
InChIKeyJOUPKKLPIYTSDI-UHFFFAOYSA-N
XLogP2.31
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.48
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-methylthiophen-2-yl)sulfonyl-4-(thiolan-3-yl)-1,4-diazepane
CID 134160708
1-[1-(5-methylthiophen-2-yl)sulfonylpiperidin-4-yl]pyrrolidine-2,5-dione
CID 113083144
3-methyl-1-(5-methylthiophen-2-yl)sulfonylpiperidine
CID 4729251
1-[1-(5-methylthiophen-2-yl)sulfonylpiperidin-4-yl]ethanamine
CID 63595170
[1-[1-(5-methylthiophen-2-yl)sulfonylpiperidin-4-yl]pyrrolidin-2-yl]methanol
CID 71809863
1-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanone
CID 110659307
1-(5-methylthiophen-2-yl)sulfonylpyrrolidin-3-amine
CID 62067377
3-(2-methylpiperidin-1-yl)-6-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]pyridazine
CID 122335925
2-[1-(5-methylthiophen-2-yl)sulfonylpiperidin-4-yl]acetic acid
CID 78980451
1-(5-methylthiophen-2-yl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 119971533
(3S)-1-(5-methylthiophen-2-yl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 119993403
4-(benzenesulfonyl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine
CID 90589444

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine?
The IUPAC name of 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine (CID 110708935) is 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine.
What is the SMILES notation for 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine?
The canonical SMILES for 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine is Cc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)s1.
What is the InChIKey of 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine?
The InChIKey is JOUPKKLPIYTSDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S2/c1-12-6-7-14(19-12)20(17,18)16-10-8-15(9-11-16)13-4-2-3-5-13/h6-7,13H,2-5,8-11H2,1H3.
What are the key properties of 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine?
1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine has a molecular weight of 314.48 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine is sourced from PubChem (CID 110708935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).