hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride

C11H17ClN2O3S — CID 51066589

IUPAChydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride
SMILESCOc1ccccc1S(=O)(=O)N1CCNCC1.[Cl-].[H+]
InChIInChI=1S/C11H16N2O3S.ClH/c1-16-10-4-2-3-5-11(10)17(14,15)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H
InChIKeyFZEVDHUONZAWFS-UHFFFAOYSA-N
MW292.79 g/mol
LogP-2.59
Rot. Bonds3

About hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride

hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride (PubChem CID 51066589) has the molecular formula C11H17ClN2O3S and a molecular weight of 292.79 g/mol. Its IUPAC name is hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride.

Molecular Properties

Compound Namehydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride
PubChem CID51066589
Molecular FormulaC11H17ClN2O3S
Molecular Weight292.79 g/mol
Exact Mass292.06
IUPAC Namehydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride
SMILESCOc1ccccc1S(=O)(=O)N1CCNCC1.[Cl-].[H+]
InChIInChI=1S/C11H16N2O3S.ClH/c1-16-10-4-2-3-5-11(10)17(14,15)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H
InChIKeyFZEVDHUONZAWFS-UHFFFAOYSA-N
XLogP-2.59
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.79
LogP ≤ 5-2.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-(2-phenylmethoxyphenyl)sulfonylpiperazine
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1-(4-methoxyphenyl)-4-(2-methoxyphenyl)sulfonylpiperazine
CID 51109656
2-(2,5-dimethoxy-4-piperazin-1-ylsulfonylphenyl)isoindole-1,3-dione
CID 4738898
1-(2-methoxyphenyl)sulfonyl-4-methylpiperidine-4-carboxylic acid
CID 63123808
1-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]-2-phenylethanone
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3-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]pyridazine
CID 121061006

Frequently Asked Questions

What is the IUPAC name of hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride?
The IUPAC name of hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride (CID 51066589) is hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride.
What is the SMILES notation for hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride?
The canonical SMILES for hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride is COc1ccccc1S(=O)(=O)N1CCNCC1.[Cl-].[H+].
What is the InChIKey of hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride?
The InChIKey is FZEVDHUONZAWFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S.ClH/c1-16-10-4-2-3-5-11(10)17(14,15)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H.
What are the key properties of hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride?
hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride has a molecular weight of 292.79 g/mol, XLogP of -2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride is sourced from PubChem (CID 51066589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).