N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide

C13H15ClN4O2S2 — CID 51308992

IUPACN-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide
SMILESO=S(=O)(NC1CCN(c2cncc(Cl)n2)CC1)c1cccs1
InChIInChI=1S/C13H15ClN4O2S2/c14-11-8-15-9-12(16-11)18-5-3-10(4-6-18)17-22(19,20)13-2-1-7-21-13/h1-2,7-10,17H,3-6H2
InChIKeyPNFWSKJPLAXCCU-UHFFFAOYSA-N
MW358.88 g/mol
LogP2.14
Rot. Bonds4

About N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide

N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide (PubChem CID 51308992) has the molecular formula C13H15ClN4O2S2 and a molecular weight of 358.88 g/mol. Its IUPAC name is N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide
PubChem CID51308992
Molecular FormulaC13H15ClN4O2S2
Molecular Weight358.88 g/mol
Exact Mass358.03
IUPAC NameN-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide
SMILESO=S(=O)(NC1CCN(c2cncc(Cl)n2)CC1)c1cccs1
InChIInChI=1S/C13H15ClN4O2S2/c14-11-8-15-9-12(16-11)18-5-3-10(4-6-18)17-22(19,20)13-2-1-7-21-13/h1-2,7-10,17H,3-6H2
InChIKeyPNFWSKJPLAXCCU-UHFFFAOYSA-N
XLogP2.14
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.88
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[4-(thiophen-2-ylsulfonylamino)piperidin-1-yl]pyrazine-2-carboxylic acid
CID 122047696
N-[1-[5-(trifluoromethoxy)-2-pyridinyl]piperidin-4-yl]thiophene-2-sulfonamide
CID 133489295
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]thiophene-2-sulfonamide
CID 33348692
N-[1-[2-(difluoromethyl)quinazolin-4-yl]piperidin-4-yl]thiophene-2-sulfonamide
CID 56554229
N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]thiophene-2-sulfonamide;hydrochloride
CID 119291177
N-propan-2-yl-4-(thiophen-2-ylsulfonylamino)piperidine-1-carboxamide
CID 110822400
ethyl 4-[4-(thiophen-2-ylsulfonylamino)piperidine-1-carbonyl]piperidine-1-carboxylate
CID 33170749
N-[1-[2-[(6-chloropyridazin-3-yl)-methylamino]acetyl]piperidin-4-yl]thiophene-2-sulfonamide
CID 39122749
N-(1-methylsulfonylpyrrolidin-3-yl)thiophene-2-sulfonamide
CID 110871311
N-[1-(2,6-difluorophenyl)sulfonylpiperidin-4-yl]thiophene-2-sulfonamide
CID 46558306
N-cyclopropyl-N-ethyl-2-[4-(thiophen-2-ylsulfonylamino)piperidin-1-yl]acetamide
CID 55648993
N-[1-[2-methyl-3-(methylamino)propanoyl]piperidin-4-yl]thiophene-2-sulfonamide
CID 119726760

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide?
The IUPAC name of N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide (CID 51308992) is N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide?
The canonical SMILES for N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide is O=S(=O)(NC1CCN(c2cncc(Cl)n2)CC1)c1cccs1.
What is the InChIKey of N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide?
The InChIKey is PNFWSKJPLAXCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O2S2/c14-11-8-15-9-12(16-11)18-5-3-10(4-6-18)17-22(19,20)13-2-1-7-21-13/h1-2,7-10,17H,3-6H2.
What are the key properties of N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide?
N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide has a molecular weight of 358.88 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]thiophene-2-sulfonamide is sourced from PubChem (CID 51308992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).