N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide

C14H17N3O2S2 — CID 102430110

IUPACN-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(N2CCNCC2)c1)c1cccs1
InChIInChI=1S/C14H17N3O2S2/c18-21(19,14-5-2-10-20-14)16-12-3-1-4-13(11-12)17-8-6-15-7-9-17/h1-5,10-11,15-16H,6-9H2
InChIKeyWPIGDYAJVCSPPL-UHFFFAOYSA-N
MW323.44 g/mol
LogP1.96
Rot. Bonds4

About N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide

N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide (PubChem CID 102430110) has the molecular formula C14H17N3O2S2 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide
PubChem CID102430110
Molecular FormulaC14H17N3O2S2
Molecular Weight323.44 g/mol
Exact Mass323.08
IUPAC NameN-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(N2CCNCC2)c1)c1cccs1
InChIInChI=1S/C14H17N3O2S2/c18-21(19,14-5-2-10-20-14)16-12-3-1-4-13(11-12)17-8-6-15-7-9-17/h1-5,10-11,15-16H,6-9H2
InChIKeyWPIGDYAJVCSPPL-UHFFFAOYSA-N
XLogP1.96
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(1,1-dioxothiazinan-2-yl)phenyl]thiophene-2-sulfonamide
CID 112505540
1-thiophen-2-ylsulfonylpiperazine
CID 3865892
5-chloro-N-(3-pyrrolidin-1-ylphenyl)thiophene-2-sulfonamide
CID 110361652
N-[4-(2-oxoimidazolidin-1-yl)phenyl]thiophene-2-sulfonamide
CID 60707214
N-[3-(morpholin-4-ylmethyl)phenyl]thiophene-2-sulfonamide
CID 51698921
N-(3-nitrophenyl)thiophene-2-sulfonamide
CID 768865
N-benzyl-2-piperazin-1-yl-5-(thiophen-2-ylsulfonylamino)benzamide;2,2,2-trifluoroacetic acid
CID 146062492
N-[3-(6-piperidin-1-ylpyridazin-3-yl)phenyl]thiophene-2-sulfonamide
CID 7520734
N-(5-piperidin-1-yl-2-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 78899574
N-[4-(4-propylpiperazin-1-yl)phenyl]thiophene-2-sulfonamide
CID 112502661
N-[3-(3-aminoprop-1-ynyl)phenyl]thiophene-2-sulfonamide
CID 60813110
N-(3-cyclopentylsulfonylphenyl)thiophene-2-sulfonamide
CID 38945179

Frequently Asked Questions

What is the IUPAC name of N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide (CID 102430110) is N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1cccc(N2CCNCC2)c1)c1cccs1.
What is the InChIKey of N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide?
The InChIKey is WPIGDYAJVCSPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S2/c18-21(19,14-5-2-10-20-14)16-12-3-1-4-13(11-12)17-8-6-15-7-9-17/h1-5,10-11,15-16H,6-9H2.
What are the key properties of N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide?
N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide has a molecular weight of 323.44 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-piperazin-1-ylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 102430110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).