1-(4-methylpiperidin-1-yl)sulfonylpiperazine

C10H21N3O2S — CID 6458546

IUPAC1-(4-methylpiperidin-1-yl)sulfonylpiperazine
SMILESCC1CCN(S(=O)(=O)N2CCNCC2)CC1
InChIInChI=1S/C10H21N3O2S/c1-10-2-6-12(7-3-10)16(14,15)13-8-4-11-5-9-13/h10-11H,2-9H2,1H3
InChIKeyBTUPAESYEQROLR-UHFFFAOYSA-N
MW247.36 g/mol
LogP-0.13
Rot. Bonds2

About 1-(4-methylpiperidin-1-yl)sulfonylpiperazine

1-(4-methylpiperidin-1-yl)sulfonylpiperazine (PubChem CID 6458546) has the molecular formula C10H21N3O2S and a molecular weight of 247.36 g/mol. Its IUPAC name is 1-(4-methylpiperidin-1-yl)sulfonylpiperazine.

Molecular Properties

Compound Name1-(4-methylpiperidin-1-yl)sulfonylpiperazine
PubChem CID6458546
Molecular FormulaC10H21N3O2S
Molecular Weight247.36 g/mol
Exact Mass247.14
IUPAC Name1-(4-methylpiperidin-1-yl)sulfonylpiperazine
SMILESCC1CCN(S(=O)(=O)N2CCNCC2)CC1
InChIInChI=1S/C10H21N3O2S/c1-10-2-6-12(7-3-10)16(14,15)13-8-4-11-5-9-13/h10-11H,2-9H2,1H3
InChIKeyBTUPAESYEQROLR-UHFFFAOYSA-N
XLogP-0.13
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperidin-1-yl)sulfonylpiperazine?
The IUPAC name of 1-(4-methylpiperidin-1-yl)sulfonylpiperazine (CID 6458546) is 1-(4-methylpiperidin-1-yl)sulfonylpiperazine.
What is the SMILES notation for 1-(4-methylpiperidin-1-yl)sulfonylpiperazine?
The canonical SMILES for 1-(4-methylpiperidin-1-yl)sulfonylpiperazine is CC1CCN(S(=O)(=O)N2CCNCC2)CC1.
What is the InChIKey of 1-(4-methylpiperidin-1-yl)sulfonylpiperazine?
The InChIKey is BTUPAESYEQROLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2S/c1-10-2-6-12(7-3-10)16(14,15)13-8-4-11-5-9-13/h10-11H,2-9H2,1H3.
What are the key properties of 1-(4-methylpiperidin-1-yl)sulfonylpiperazine?
1-(4-methylpiperidin-1-yl)sulfonylpiperazine has a molecular weight of 247.36 g/mol, XLogP of -0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperidin-1-yl)sulfonylpiperazine is sourced from PubChem (CID 6458546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).