(2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine

C12H22N4O2S — CID 82755485

IUPAC(2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine
SMILESCCCn1cc(S(=O)(=O)N2CCNC[C@H]2C)nc1C
InChIInChI=1S/C12H22N4O2S/c1-4-6-15-9-12(14-11(15)3)19(17,18)16-7-5-13-8-10(16)2/h9-10,13H,4-8H2,1-3H3/t10-/m1/s1
InChIKeyUQCMUHWUUAWEJU-SNVBAGLBSA-N
MW286.40 g/mol
LogP0.58
Rot. Bonds4

About (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine

(2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine (PubChem CID 82755485) has the molecular formula C12H22N4O2S and a molecular weight of 286.40 g/mol. Its IUPAC name is (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine.

Molecular Properties

Compound Name(2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine
PubChem CID82755485
Molecular FormulaC12H22N4O2S
Molecular Weight286.40 g/mol
Exact Mass286.15
IUPAC Name(2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine
SMILESCCCn1cc(S(=O)(=O)N2CCNC[C@H]2C)nc1C
InChIInChI=1S/C12H22N4O2S/c1-4-6-15-9-12(14-11(15)3)19(17,18)16-7-5-13-8-10(16)2/h9-10,13H,4-8H2,1-3H3/t10-/m1/s1
InChIKeyUQCMUHWUUAWEJU-SNVBAGLBSA-N
XLogP0.58
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine?
The IUPAC name of (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine (CID 82755485) is (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine.
What is the SMILES notation for (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine?
The canonical SMILES for (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine is CCCn1cc(S(=O)(=O)N2CCNC[C@H]2C)nc1C.
What is the InChIKey of (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine?
The InChIKey is UQCMUHWUUAWEJU-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H22N4O2S/c1-4-6-15-9-12(14-11(15)3)19(17,18)16-7-5-13-8-10(16)2/h9-10,13H,4-8H2,1-3H3/t10-/m1/s1.
What are the key properties of (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine?
(2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine has a molecular weight of 286.40 g/mol, XLogP of 0.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-(2-methyl-1-propylimidazol-4-yl)sulfonylpiperazine is sourced from PubChem (CID 82755485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).