(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine

C11H23N3O2S — CID 124598606

IUPAC(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine
SMILESC[C@H]1CCCN(S(=O)(=O)N2CCNC[C@H]2C)C1
InChIInChI=1S/C11H23N3O2S/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/t10-,11+/m0/s1
InChIKeyOORYSZQYRLEKRE-WDEREUQCSA-N
MW261.39 g/mol
LogP0.26
Rot. Bonds2

About (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine

(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine (PubChem CID 124598606) has the molecular formula C11H23N3O2S and a molecular weight of 261.39 g/mol. Its IUPAC name is (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine.

Molecular Properties

Compound Name(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine
PubChem CID124598606
Molecular FormulaC11H23N3O2S
Molecular Weight261.39 g/mol
Exact Mass261.15
IUPAC Name(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine
SMILESC[C@H]1CCCN(S(=O)(=O)N2CCNC[C@H]2C)C1
InChIInChI=1S/C11H23N3O2S/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/t10-,11+/m0/s1
InChIKeyOORYSZQYRLEKRE-WDEREUQCSA-N
XLogP0.26
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
CID 119970141
2-methyl-1-pyrrolidin-1-ylsulfonylpiperazine;hydrochloride
CID 119969723
(2R)-2-methyl-1-(4-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
CID 120716948
1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
CID 119961883
3-methyl-1-(2-piperidin-3-ylpyrrolidin-1-yl)sulfonylpiperidine
CID 60977614
2-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperazine
CID 62671714
2,6-dimethyl-4-(2-methylpiperazin-1-yl)sulfonylmorpholine;hydrochloride
CID 119969720
4-(2-methylpiperazin-1-yl)sulfonylmorpholine
CID 62674194
(3R)-3-methyl-1-(3-methylpiperidin-1-yl)sulfonylpiperazine
CID 104975049
(3R)-3-methyl-N-[(3R,4S)-3-methylpiperidin-4-yl]piperidine-1-sulfonamide
CID 129431135
(3S)-1-(3-methylpiperidin-1-yl)sulfonylpiperidin-3-ol
CID 107225019
1-(3-methylpiperidin-1-yl)sulfonylpiperidin-3-ol
CID 43503036

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine?
The IUPAC name of (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine (CID 124598606) is (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine.
What is the SMILES notation for (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine?
The canonical SMILES for (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine is C[C@H]1CCCN(S(=O)(=O)N2CCNC[C@H]2C)C1.
What is the InChIKey of (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine?
The InChIKey is OORYSZQYRLEKRE-WDEREUQCSA-N. The full InChI is InChI=1S/C11H23N3O2S/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/t10-,11+/m0/s1.
What are the key properties of (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine?
(2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine has a molecular weight of 261.39 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-[(3S)-3-methylpiperidin-1-yl]sulfonylpiperazine is sourced from PubChem (CID 124598606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).