2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride

C11H24ClN3O2S — CID 119970141

IUPAC2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
SMILESCC1CCCN(S(=O)(=O)N2CCNCC2C)C1.Cl
InChIInChI=1S/C11H23N3O2S.ClH/c1-10-4-3-6-13(9-10)17(15,16)14-7-5-12-8-11(14)2;/h10-12H,3-9H2,1-2H3;1H
InChIKeyWSCGNFCHZLFQHC-UHFFFAOYSA-N
MW297.85 g/mol
LogP0.68
Rot. Bonds2

About 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride

2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride (PubChem CID 119970141) has the molecular formula C11H24ClN3O2S and a molecular weight of 297.85 g/mol. Its IUPAC name is 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride.

Molecular Properties

Compound Name2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
PubChem CID119970141
Molecular FormulaC11H24ClN3O2S
Molecular Weight297.85 g/mol
Exact Mass297.13
IUPAC Name2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
SMILESCC1CCCN(S(=O)(=O)N2CCNCC2C)C1.Cl
InChIInChI=1S/C11H23N3O2S.ClH/c1-10-4-3-6-13(9-10)17(15,16)14-7-5-12-8-11(14)2;/h10-12H,3-9H2,1-2H3;1H
InChIKeyWSCGNFCHZLFQHC-UHFFFAOYSA-N
XLogP0.68
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.85
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine
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(2R)-2-methyl-1-(4-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
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1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
CID 119961883
3-methyl-1-(2-piperidin-3-ylpyrrolidin-1-yl)sulfonylpiperidine
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2,6-dimethyl-4-(2-methylpiperazin-1-yl)sulfonylmorpholine;hydrochloride
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2-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperazine
CID 62671714
4-(2-methylpiperazin-1-yl)sulfonylmorpholine
CID 62674194
(3R)-3-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine
CID 104975049
N,3-dimethyl-N-pyrrolidin-3-ylpiperidine-1-sulfonamide;hydrochloride
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(3R)-3-methyl-N-[(3R,4S)-3-methylpiperidin-4-yl]piperidine-1-sulfonamide
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CID 119962874

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride?
The IUPAC name of 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride (CID 119970141) is 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride.
What is the SMILES notation for 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride?
The canonical SMILES for 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride is CC1CCCN(S(=O)(=O)N2CCNCC2C)C1.Cl.
What is the InChIKey of 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride?
The InChIKey is WSCGNFCHZLFQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2S.ClH/c1-10-4-3-6-13(9-10)17(15,16)14-7-5-12-8-11(14)2;/h10-12H,3-9H2,1-2H3;1H.
What are the key properties of 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride?
2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride has a molecular weight of 297.85 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride is sourced from PubChem (CID 119970141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).