N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide

C8H18N4O3S — CID 112683880

IUPACN,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide
SMILESCN(C)C(=O)CN1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C8H18N4O3S/c1-10(2)8(13)7-11-3-5-12(6-4-11)16(9,14)15/h3-7H2,1-2H3,(H2,9,14,15)
InChIKeyLDTZXTOVIJSIIN-UHFFFAOYSA-N
MW250.32 g/mol
LogP-2.10
Rot. Bonds3

About N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide

N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide (PubChem CID 112683880) has the molecular formula C8H18N4O3S and a molecular weight of 250.32 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide
PubChem CID112683880
Molecular FormulaC8H18N4O3S
Molecular Weight250.32 g/mol
Exact Mass250.11
IUPAC NameN,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide
SMILESCN(C)C(=O)CN1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C8H18N4O3S/c1-10(2)8(13)7-11-3-5-12(6-4-11)16(9,14)15/h3-7H2,1-2H3,(H2,9,14,15)
InChIKeyLDTZXTOVIJSIIN-UHFFFAOYSA-N
XLogP-2.10
TPSA86.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 5-2.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(chloromethylsulfonyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 55246213
N,N-dimethyl-2-(4-propan-2-ylsulfonyl-1,4-diazepan-1-yl)acetamide
CID 61355697
2-(azetidin-1-yl)-N,N-dimethylacetamide
CID 69256971
3-[[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]sulfonyl]propanoic acid
CID 60951472
N,N-dimethyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide
CID 9111668
N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane
CID 142367549
N,N-dimethyl-2-[4-(2-sulfamoylethylamino)piperidin-1-yl]acetamide
CID 43777289
2-(4,4-dimethylpiperidin-1-yl)-N,N-dimethylacetamide
CID 127272826
2-(4-acetyl-1,4-diazepan-1-yl)-N,N-dimethylacetamide
CID 60699636
4,7-bis(carboxymethyl)-10-[2-(dimethylamino)-2-oxoethyl]-1,4,7,10-tetrazacyclododecane-1-carboxylic acid
CID 20603350
methyl (2R)-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanoate
CID 94526452
N,N-dimethyl-2-(4-methylpiperidin-1-yl)acetamide;ethane
CID 145317125

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide (CID 112683880) is N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide is CN(C)C(=O)CN1CCN(S(N)(=O)=O)CC1.
What is the InChIKey of N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide?
The InChIKey is LDTZXTOVIJSIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O3S/c1-10(2)8(13)7-11-3-5-12(6-4-11)16(9,14)15/h3-7H2,1-2H3,(H2,9,14,15).
What are the key properties of N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide?
N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide has a molecular weight of 250.32 g/mol, XLogP of -2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide is sourced from PubChem (CID 112683880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).