N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide

C10H8ClN5O2S — CID 71713994

IUPACN'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide
SMILESN/C(=N\S(=O)(=O)c1cnccc1Cl)c1cnccn1
InChIInChI=1S/C10H8ClN5O2S/c11-7-1-2-13-6-9(7)19(17,18)16-10(12)8-5-14-3-4-15-8/h1-6H,(H2,12,16)
InChIKeyHLELNGSIRFIGAN-UHFFFAOYSA-N
MW297.73 g/mol
LogP0.62
Rot. Bonds3

About N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide

N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide (PubChem CID 71713994) has the molecular formula C10H8ClN5O2S and a molecular weight of 297.73 g/mol. Its IUPAC name is N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide.

Molecular Properties

Compound NameN'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide
PubChem CID71713994
Molecular FormulaC10H8ClN5O2S
Molecular Weight297.73 g/mol
Exact Mass297.01
IUPAC NameN'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide
SMILESN/C(=N\S(=O)(=O)c1cnccc1Cl)c1cnccn1
InChIInChI=1S/C10H8ClN5O2S/c11-7-1-2-13-6-9(7)19(17,18)16-10(12)8-5-14-3-4-15-8/h1-6H,(H2,12,16)
InChIKeyHLELNGSIRFIGAN-UHFFFAOYSA-N
XLogP0.62
TPSA111.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.73
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-(2-chlorophenyl)sulfonylpyrazine-2-carboximidamide
CID 78156545
N'-(4-aminophenyl)sulfonylpyrazine-2-carboximidamide
CID 72682316
methyl N'-[(4-chloro-3-pyridinyl)sulfonyl]carbamimidate
CID 119084852
N'-(4-methylphenyl)sulfonylpyrazine-2-carboximidamide
CID 170856051
N'-tert-butylpyrazine-2-carboximidamide
CID 63181941
N'-[methyl(methylsulfonyl)amino]pyrazine-2-carboximidamide
CID 170856466
N'-propan-2-ylpyrazine-2-carboximidamide
CID 63181346
[[amino(pyrazin-2-yl)methylidene]amino] 2-chloroacetate
CID 4293110
4-chloro-N-(3-hydroxy-2,3-dimethylbutan-2-yl)pyridine-3-sulfonamide
CID 104940865
(3R)-1-[(4-chloro-3-pyridinyl)sulfonyl]pyrrolidin-3-ol
CID 104940811
(3-chloro-4-iodophenyl)-pyrazin-2-ylmethanone
CID 103214115
4-chloro-N-cyclohexylpyridine-3-sulfonamide
CID 10492602

Frequently Asked Questions

What is the IUPAC name of N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide?
The IUPAC name of N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide (CID 71713994) is N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide.
What is the SMILES notation for N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide?
The canonical SMILES for N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide is N/C(=N\S(=O)(=O)c1cnccc1Cl)c1cnccn1.
What is the InChIKey of N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide?
The InChIKey is HLELNGSIRFIGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN5O2S/c11-7-1-2-13-6-9(7)19(17,18)16-10(12)8-5-14-3-4-15-8/h1-6H,(H2,12,16).
What are the key properties of N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide?
N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide has a molecular weight of 297.73 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(4-chloro-3-pyridinyl)sulfonyl]pyrazine-2-carboximidamide is sourced from PubChem (CID 71713994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).