N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide

C7H6ClN5O2S — CID 102990020

IUPACN-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide
SMILESO=S(=O)(Nc1nccnc1Cl)c1ccn[nH]1
InChIInChI=1S/C7H6ClN5O2S/c8-6-7(10-4-3-9-6)13-16(14,15)5-1-2-11-12-5/h1-4H,(H,10,13)(H,11,12)
InChIKeyNXMHQGVBMHMSJH-UHFFFAOYSA-N
MW259.68 g/mol
LogP0.65
Rot. Bonds3

About N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide

N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide (PubChem CID 102990020) has the molecular formula C7H6ClN5O2S and a molecular weight of 259.68 g/mol. Its IUPAC name is N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide
PubChem CID102990020
Molecular FormulaC7H6ClN5O2S
Molecular Weight259.68 g/mol
Exact Mass258.99
IUPAC NameN-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide
SMILESO=S(=O)(Nc1nccnc1Cl)c1ccn[nH]1
InChIInChI=1S/C7H6ClN5O2S/c8-6-7(10-4-3-9-6)13-16(14,15)5-1-2-11-12-5/h1-4H,(H,10,13)(H,11,12)
InChIKeyNXMHQGVBMHMSJH-UHFFFAOYSA-N
XLogP0.65
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.68
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide
CID 102690598
N-(3-bromo-2-pyridinyl)-1H-pyrazole-5-sulfonamide
CID 102691291
2-chloro-3-(sulfamoylamino)pyrazine
CID 102989841
N-[4-(methylamino)phenyl]-1H-pyrazole-5-sulfonamide
CID 102693540
N-(3-chlorophenyl)-1H-pyrazole-5-sulfonamide
CID 102691568
N-(8-chloroquinolin-5-yl)-1H-pyrazole-5-sulfonamide
CID 102692686
2,3-dichloro-N-(3-chloropyrazin-2-yl)benzenesulfonamide
CID 59168167
2,4,6-trichloro-N-(3-chloropyrazin-2-yl)benzenesulfonamide
CID 102989994
N-(2-chloro-4-methylphenyl)-1H-pyrazole-5-sulfonamide
CID 102691623
N-(3-chloropyrazin-2-yl)-2-methylbenzenesulfonamide
CID 102990036
2,5-dichloro-N-(3-chloropyrazin-2-yl)benzenesulfonamide
CID 102989905
2-chloro-4-(1H-pyrazol-5-ylsulfonylamino)benzenesulfonyl chloride
CID 102691039

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide (CID 102990020) is N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide is O=S(=O)(Nc1nccnc1Cl)c1ccn[nH]1.
What is the InChIKey of N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide?
The InChIKey is NXMHQGVBMHMSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN5O2S/c8-6-7(10-4-3-9-6)13-16(14,15)5-1-2-11-12-5/h1-4H,(H,10,13)(H,11,12).
What are the key properties of N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide?
N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide has a molecular weight of 259.68 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropyrazin-2-yl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102990020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).