N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide

C11H17N3O3S2 — CID 976572

IUPACN,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C11H17N3O3S2/c1-12(2)19(16,17)14-7-5-13(6-8-14)11(15)10-4-3-9-18-10/h3-4,9H,5-8H2,1-2H3
InChIKeyVJJYHYHDTNKLPG-UHFFFAOYSA-N
MW303.41 g/mol
LogP0.31
Rot. Bonds3

About N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide

N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide (PubChem CID 976572) has the molecular formula C11H17N3O3S2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide
PubChem CID976572
Molecular FormulaC11H17N3O3S2
Molecular Weight303.41 g/mol
Exact Mass303.07
IUPAC NameN,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C11H17N3O3S2/c1-12(2)19(16,17)14-7-5-13(6-8-14)11(15)10-4-3-9-18-10/h3-4,9H,5-8H2,1-2H3
InChIKeyVJJYHYHDTNKLPG-UHFFFAOYSA-N
XLogP0.31
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 1245731
Thiophene-2-carboxylic acid, morpholide
CID 531921
N1-methyl-N4-[5-(thien-2-yl)-thien-2-oyl)piperazine
CID 2814290
N2,N2-dimethyl-4-(isopropylsulfonyl)-5-(methylthio)thiophene-2-carboxamide
CID 2820417
N-(1-Methyl-2-(1-piperidinyl)ethyl)-2-thiophenecarboxamide
CID 2971109
Thiophen-2-yl-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone
CID 4779966
4-[(3-Methyl-1-piperidinyl)sulfonyl]-2-thiophenecarboxamide
CID 6486032
N-(1,1-dioxothiolan-3-yl)-N-ethylthiophene-2-carboxamide
CID 18573629
N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 25162372
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]thiophene-2-carboxamide
CID 40233426
(4-Ethylsulfonylpiperazin-1-yl)-thiophen-2-ylmethanone
CID 770531
4-[(4-Fluorophenyl)sulfonyl]piperazinyl 2-thienyl ketone
CID 1094979

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide (CID 976572) is N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide is CN(C)S(=O)(=O)N1CCN(C(=O)c2cccs2)CC1.
What is the InChIKey of N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide?
The InChIKey is VJJYHYHDTNKLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S2/c1-12(2)19(16,17)14-7-5-13(6-8-14)11(15)10-4-3-9-18-10/h3-4,9H,5-8H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide?
N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide has a molecular weight of 303.41 g/mol, XLogP of 0.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(thiophene-2-carbonyl)piperazine-1-sulfonamide is sourced from PubChem (CID 976572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).