(2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide

C14H22N4O3S — CID 34787872

IUPAC(2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide
SMILESCN(C)S(=O)(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1
InChIInChI=1S/C14H22N4O3S/c1-16(2)22(20,21)18-10-8-17(9-11-18)13(14(15)19)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H2,15,19)/t13-/m1/s1
InChIKeyIVBRMYTYQKHAMT-CYBMUJFWSA-N
MW326.42 g/mol
LogP-0.36
Rot. Bonds5

About (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide

(2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide (PubChem CID 34787872) has the molecular formula C14H22N4O3S and a molecular weight of 326.42 g/mol. Its IUPAC name is (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide
PubChem CID34787872
Molecular FormulaC14H22N4O3S
Molecular Weight326.42 g/mol
Exact Mass326.14
IUPAC Name(2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide
SMILESCN(C)S(=O)(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1
InChIInChI=1S/C14H22N4O3S/c1-16(2)22(20,21)18-10-8-17(9-11-18)13(14(15)19)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H2,15,19)/t13-/m1/s1
InChIKeyIVBRMYTYQKHAMT-CYBMUJFWSA-N
XLogP-0.36
TPSA86.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazin-1-yl]-2-phenylacetamide
CID 40972974
(2R)-2-(4-acetylpiperazin-1-yl)-2-phenylacetamide
CID 51908871
(2R)-N,N-dimethyl-2-(4-methylsulfonylpiperazin-1-yl)-2-phenylacetamide
CID 31873332
2-(azocan-1-yl)-2-phenylacetamide
CID 42889497
2-(4-ethylpiperazin-1-yl)-2-phenylacetamide
CID 86915510
(2S)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N,N-dimethyl-2-phenylacetamide
CID 8692627
2-phenyl-2-piperidin-1-ylacetamide;hydrochloride
CID 138401908
(2R)-2-[4-[(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]piperazin-1-yl]-N,N-dimethyl-2-phenylacetamide
CID 30740688
2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-phenylacetic acid
CID 146128266
2-(4-methylsulfonylpiperazin-1-yl)-2-phenylacetohydrazide
CID 63574186
(2R)-2-phenyl-2-piperazin-1-ylacetamide
CID 28805503
2-[4-(2-chlorophenyl)piperazin-1-yl]-2-phenylacetamide
CID 17433888

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide?
The IUPAC name of (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide (CID 34787872) is (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide is CN(C)S(=O)(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1.
What is the InChIKey of (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide?
The InChIKey is IVBRMYTYQKHAMT-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H22N4O3S/c1-16(2)22(20,21)18-10-8-17(9-11-18)13(14(15)19)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H2,15,19)/t13-/m1/s1.
What are the key properties of (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide?
(2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide has a molecular weight of 326.42 g/mol, XLogP of -0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-(dimethylsulfamoyl)piperazin-1-yl]-2-phenylacetamide is sourced from PubChem (CID 34787872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).