1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine

C10H22N4O2S — CID 67401627

IUPAC1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine
SMILESCN1CCN(S(=O)(=O)N2CCC(N)CC2)CC1
InChIInChI=1S/C10H22N4O2S/c1-12-6-8-14(9-7-12)17(15,16)13-4-2-10(11)3-5-13/h10H,2-9,11H2,1H3
InChIKeyCXPNGOGSYTYPRS-UHFFFAOYSA-N
MW262.38 g/mol
LogP-1.10
Rot. Bonds2

About 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine

1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine (PubChem CID 67401627) has the molecular formula C10H22N4O2S and a molecular weight of 262.38 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine
PubChem CID67401627
Molecular FormulaC10H22N4O2S
Molecular Weight262.38 g/mol
Exact Mass262.15
IUPAC Name1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine
SMILESCN1CCN(S(=O)(=O)N2CCC(N)CC2)CC1
InChIInChI=1S/C10H22N4O2S/c1-12-6-8-14(9-7-12)17(15,16)13-4-2-10(11)3-5-13/h10H,2-9,11H2,1H3
InChIKeyCXPNGOGSYTYPRS-UHFFFAOYSA-N
XLogP-1.10
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 5-1.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine?
The IUPAC name of 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine (CID 67401627) is 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine is CN1CCN(S(=O)(=O)N2CCC(N)CC2)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine?
The InChIKey is CXPNGOGSYTYPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2S/c1-12-6-8-14(9-7-12)17(15,16)13-4-2-10(11)3-5-13/h10H,2-9,11H2,1H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine?
1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine has a molecular weight of 262.38 g/mol, XLogP of -1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-amine is sourced from PubChem (CID 67401627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).