N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide

C14H25N3O2S2 — CID 25048155

IUPACN-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide
SMILESCCN1CCN(CC(C)(C)NS(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C14H25N3O2S2/c1-4-16-7-9-17(10-8-16)12-14(2,3)15-21(18,19)13-6-5-11-20-13/h5-6,11,15H,4,7-10,12H2,1-3H3
InChIKeyMKXATFCKZHIGNZ-UHFFFAOYSA-N
MW331.51 g/mol
LogP1.44
Rot. Bonds6

About N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide

N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide (PubChem CID 25048155) has the molecular formula C14H25N3O2S2 and a molecular weight of 331.51 g/mol. Its IUPAC name is N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide
PubChem CID25048155
Molecular FormulaC14H25N3O2S2
Molecular Weight331.51 g/mol
Exact Mass331.14
IUPAC NameN-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide
SMILESCCN1CCN(CC(C)(C)NS(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C14H25N3O2S2/c1-4-16-7-9-17(10-8-16)12-14(2,3)15-21(18,19)13-6-5-11-20-13/h5-6,11,15H,4,7-10,12H2,1-3H3
InChIKeyMKXATFCKZHIGNZ-UHFFFAOYSA-N
XLogP1.44
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.51
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-methyl-1-piperidin-1-ium-1-ylpropan-2-yl)thiophene-2-sulfonamide
CID 2317336
N-(1-hydroxy-2-methylbutan-2-yl)thiophene-2-sulfonamide
CID 64555451
N-[3-(bromomethyl)pentan-3-yl]thiophene-2-sulfonamide
CID 114294053
methyl (2R)-2-methyl-2-(thiophen-2-ylsulfonylamino)pentanoate
CID 93045702
2-methyl-2-(thiophen-2-ylsulfonylamino)propanethioamide
CID 61121428
N-[4-(4-propylpiperazin-1-yl)phenyl]thiophene-2-sulfonamide
CID 112502661
N-(2-pyrrolidin-1-ylethyl)thiophene-2-sulfonamide
CID 91007223
N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide
CID 24680238
3-(4-ethylpiperazin-1-yl)-N-(2-thiophen-2-ylpropan-2-yl)propanamide
CID 71866753
N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955
N-[(3R)-1-(2,2-dimethylpropyl)-5-oxopyrrolidin-3-yl]thiophene-2-sulfonamide
CID 42595762
(2S)-3-methyl-N-[3-(4-propylpiperazin-1-yl)propyl]-2-(thiophen-2-ylsulfonylamino)butanamide
CID 92712119

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide?
The IUPAC name of N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide (CID 25048155) is N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide?
The canonical SMILES for N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide is CCN1CCN(CC(C)(C)NS(=O)(=O)c2cccs2)CC1.
What is the InChIKey of N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide?
The InChIKey is MKXATFCKZHIGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2S2/c1-4-16-7-9-17(10-8-16)12-14(2,3)15-21(18,19)13-6-5-11-20-13/h5-6,11,15H,4,7-10,12H2,1-3H3.
What are the key properties of N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide?
N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide has a molecular weight of 331.51 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylpiperazin-1-yl)-2-methylpropan-2-yl]thiophene-2-sulfonamide is sourced from PubChem (CID 25048155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).