N-pyrazin-2-ylbutane-1-sulfonamide

C8H13N3O2S — CID 22772906

IUPACN-pyrazin-2-ylbutane-1-sulfonamide
SMILESCCCCS(=O)(=O)Nc1cnccn1
InChIInChI=1S/C8H13N3O2S/c1-2-3-6-14(12,13)11-8-7-9-4-5-10-8/h4-5,7H,2-3,6H2,1H3,(H,10,11)
InChIKeyZBUKHSIHRXPDQK-UHFFFAOYSA-N
MW215.28 g/mol
LogP1.02
Rot. Bonds5

About N-pyrazin-2-ylbutane-1-sulfonamide

N-pyrazin-2-ylbutane-1-sulfonamide (PubChem CID 22772906) has the molecular formula C8H13N3O2S and a molecular weight of 215.28 g/mol. Its IUPAC name is N-pyrazin-2-ylbutane-1-sulfonamide.

Molecular Properties

Compound NameN-pyrazin-2-ylbutane-1-sulfonamide
PubChem CID22772906
Molecular FormulaC8H13N3O2S
Molecular Weight215.28 g/mol
Exact Mass215.07
IUPAC NameN-pyrazin-2-ylbutane-1-sulfonamide
SMILESCCCCS(=O)(=O)Nc1cnccn1
InChIInChI=1S/C8H13N3O2S/c1-2-3-6-14(12,13)11-8-7-9-4-5-10-8/h4-5,7H,2-3,6H2,1H3,(H,10,11)
InChIKeyZBUKHSIHRXPDQK-UHFFFAOYSA-N
XLogP1.02
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.28
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-chloropyrazin-2-yl)butane-1-sulfonamide
CID 104821133
N-(4-methyl-2-pyridinyl)butane-1-sulfonamide
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N-(4-chloro-2-pyridinyl)butane-1-sulfonamide
CID 104821756
N-(2-chloropyrimidin-4-yl)butane-1-sulfonamide
CID 116798844
N-[6-(butylamino)pyridazin-3-yl]butane-1-sulfonamide
CID 113038387
N-pyrazin-2-ylpentanamide
CID 91469646
N-(5-methyl-1,2-oxazol-3-yl)butane-1-sulfonamide
CID 6465435
N-methyl-2-(pyrazin-2-ylamino)ethanesulfonamide
CID 106337907
2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide
CID 62148086
N-(2-methylsulfonylethyl)pyrazin-2-amine
CID 60919263
N-tributylstannylpyrazin-2-amine
CID 141081806
1-(4-fluorophenyl)-N-pyrazin-2-ylmethanesulfonamide
CID 86804588

Frequently Asked Questions

What is the IUPAC name of N-pyrazin-2-ylbutane-1-sulfonamide?
The IUPAC name of N-pyrazin-2-ylbutane-1-sulfonamide (CID 22772906) is N-pyrazin-2-ylbutane-1-sulfonamide.
What is the SMILES notation for N-pyrazin-2-ylbutane-1-sulfonamide?
The canonical SMILES for N-pyrazin-2-ylbutane-1-sulfonamide is CCCCS(=O)(=O)Nc1cnccn1.
What is the InChIKey of N-pyrazin-2-ylbutane-1-sulfonamide?
The InChIKey is ZBUKHSIHRXPDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2S/c1-2-3-6-14(12,13)11-8-7-9-4-5-10-8/h4-5,7H,2-3,6H2,1H3,(H,10,11).
What are the key properties of N-pyrazin-2-ylbutane-1-sulfonamide?
N-pyrazin-2-ylbutane-1-sulfonamide has a molecular weight of 215.28 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrazin-2-ylbutane-1-sulfonamide is sourced from PubChem (CID 22772906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).