1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine

C18H28N2O3S — CID 110411428

IUPAC1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine
SMILESCOc1ccccc1CCN1CCN(S(=O)(=O)C2CCCC2)CC1
InChIInChI=1S/C18H28N2O3S/c1-23-18-9-5-2-6-16(18)10-11-19-12-14-20(15-13-19)24(21,22)17-7-3-4-8-17/h2,5-6,9,17H,3-4,7-8,10-15H2,1H3
InChIKeyRMOVDMXZEXTFNA-UHFFFAOYSA-N
MW352.50 g/mol
LogP2.13
Rot. Bonds6

About 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine

1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine (PubChem CID 110411428) has the molecular formula C18H28N2O3S and a molecular weight of 352.50 g/mol. Its IUPAC name is 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine.

Molecular Properties

Compound Name1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine
PubChem CID110411428
Molecular FormulaC18H28N2O3S
Molecular Weight352.50 g/mol
Exact Mass352.18
IUPAC Name1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine
SMILESCOc1ccccc1CCN1CCN(S(=O)(=O)C2CCCC2)CC1
InChIInChI=1S/C18H28N2O3S/c1-23-18-9-5-2-6-16(18)10-11-19-12-14-20(15-13-19)24(21,22)17-7-3-4-8-17/h2,5-6,9,17H,3-4,7-8,10-15H2,1H3
InChIKeyRMOVDMXZEXTFNA-UHFFFAOYSA-N
XLogP2.13
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.50
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopentylsulfonyl-4-[3-(2-methoxyphenyl)propyl]piperazine
CID 110356564
2-[4-[2-(2-methoxyphenyl)ethyl]piperazin-1-yl]ethanol
CID 94276618
1-(2-methoxyethylsulfonyl)-4-[3-(2-methoxyphenyl)propyl]piperazine
CID 110356569
1-[2-(2-methoxyphenyl)ethyl]-4-(2-phenylethyl)piperazine;dihydrochloride
CID 155541951
1-[(6-chloro-3-pyridinyl)sulfonyl]-4-[2-(2-methoxyphenyl)ethyl]piperazine
CID 110411379
N-[4-(2-methoxyphenyl)butyl]cyclopentanesulfonamide
CID 110408740
1-[3-(2-methoxyphenyl)propyl]-4-thiophen-2-ylsulfonylpiperazine
CID 110358219
1-[2-(2-methoxyphenyl)ethyl]-4-methyl-1,5-diazocane
CID 106261953
1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine
CID 82159159
1-[2-(2-methoxyphenyl)ethyl]piperazine;dihydrochloride
CID 52983547
1-[2-(2-methoxyphenyl)ethyl]piperidin-3-one
CID 83824146
1-cyclopropylsulfonyl-4-(2-phenylethyl)-1,4-diazepane
CID 154853744

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine?
The IUPAC name of 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine (CID 110411428) is 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine.
What is the SMILES notation for 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine?
The canonical SMILES for 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine is COc1ccccc1CCN1CCN(S(=O)(=O)C2CCCC2)CC1.
What is the InChIKey of 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine?
The InChIKey is RMOVDMXZEXTFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3S/c1-23-18-9-5-2-6-16(18)10-11-19-12-14-20(15-13-19)24(21,22)17-7-3-4-8-17/h2,5-6,9,17H,3-4,7-8,10-15H2,1H3.
What are the key properties of 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine?
1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine has a molecular weight of 352.50 g/mol, XLogP of 2.13, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylsulfonyl-4-[2-(2-methoxyphenyl)ethyl]piperazine is sourced from PubChem (CID 110411428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).