1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine

C20H26N2O2S — CID 11949879

IUPAC1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine
SMILESCc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)c2ccccc12
InChIInChI=1S/C20H26N2O2S/c1-16-10-11-20(19-9-5-4-8-18(16)19)25(23,24)22-14-12-21(13-15-22)17-6-2-3-7-17/h4-5,8-11,17H,2-3,6-7,12-15H2,1H3
InChIKeySDNFHILJFROFBT-UHFFFAOYSA-N
MW358.51 g/mol
LogP3.40
Rot. Bonds3

About 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine

1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine (PubChem CID 11949879) has the molecular formula C20H26N2O2S and a molecular weight of 358.51 g/mol. Its IUPAC name is 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine.

Molecular Properties

Compound Name1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine
PubChem CID11949879
Molecular FormulaC20H26N2O2S
Molecular Weight358.51 g/mol
Exact Mass358.17
IUPAC Name1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine
SMILESCc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)c2ccccc12
InChIInChI=1S/C20H26N2O2S/c1-16-10-11-20(19-9-5-4-8-18(16)19)25(23,24)22-14-12-21(13-15-22)17-6-2-3-7-17/h4-5,8-11,17H,2-3,6-7,12-15H2,1H3
InChIKeySDNFHILJFROFBT-UHFFFAOYSA-N
XLogP3.40
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.51
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-4-(2-fluorophenyl)sulfonylpiperazine
CID 45369149
3-(4-cyclohexylpiperazin-1-yl)sulfonyl-1H-indole
CID 175632553
1-cyclopentyl-4-(3,4-dimethylphenyl)sulfonylpiperazine
CID 110708923
1-cycloheptyl-4-(3,4-dimethylphenyl)sulfonylpiperazine
CID 113074953
4-(2-chlorocyclohexa-2,5-dien-1-yl)-1-(4-methylnaphthalen-1-yl)sulfonylpiperidine
CID 174595839
1-cyclohexyl-4-(2-methyl-5-nitrophenyl)sulfonylpiperazine
CID 90146968
1-cycloheptyl-4-(3-methylphenyl)sulfonylpiperazine
CID 113074976
1-(2-chlorophenyl)sulfonyl-4-cyclopropylpiperazine
CID 47454432
2-(4-cyclopropylpiperazin-1-yl)sulfonylphenol
CID 81241270
1-cyclopentyl-4-(5-methylthiophen-2-yl)sulfonylpiperazine
CID 110708935
1-(4-chloro-3-methylphenyl)sulfonyl-4-cyclohexylpiperazine
CID 113073090
4-methyl-1-(1-naphthalen-1-ylsulfonylpiperidin-4-yl)piperidine
CID 118314265

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine?
The IUPAC name of 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine (CID 11949879) is 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine.
What is the SMILES notation for 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine?
The canonical SMILES for 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine is Cc1ccc(S(=O)(=O)N2CCN(C3CCCC3)CC2)c2ccccc12.
What is the InChIKey of 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine?
The InChIKey is SDNFHILJFROFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2S/c1-16-10-11-20(19-9-5-4-8-18(16)19)25(23,24)22-14-12-21(13-15-22)17-6-2-3-7-17/h4-5,8-11,17H,2-3,6-7,12-15H2,1H3.
What are the key properties of 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine?
1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine has a molecular weight of 358.51 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(4-methylnaphthalen-1-yl)sulfonylpiperazine is sourced from PubChem (CID 11949879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).