2-chloro-5-(diethylsulfamoylamino)pyrazine

C8H13ClN4O2S — CID 107596039

IUPAC2-chloro-5-(diethylsulfamoylamino)pyrazine
SMILESCCN(CC)S(=O)(=O)Nc1cnc(Cl)cn1
InChIInChI=1S/C8H13ClN4O2S/c1-3-13(4-2)16(14,15)12-8-6-10-7(9)5-11-8/h5-6H,3-4H2,1-2H3,(H,11,12)
InChIKeyLACUHSZDFNIAOJ-UHFFFAOYSA-N
MW264.74 g/mol
LogP1.13
Rot. Bonds5

About 2-chloro-5-(diethylsulfamoylamino)pyrazine

2-chloro-5-(diethylsulfamoylamino)pyrazine (PubChem CID 107596039) has the molecular formula C8H13ClN4O2S and a molecular weight of 264.74 g/mol. Its IUPAC name is 2-chloro-5-(diethylsulfamoylamino)pyrazine.

Molecular Properties

Compound Name2-chloro-5-(diethylsulfamoylamino)pyrazine
PubChem CID107596039
Molecular FormulaC8H13ClN4O2S
Molecular Weight264.74 g/mol
Exact Mass264.04
IUPAC Name2-chloro-5-(diethylsulfamoylamino)pyrazine
SMILESCCN(CC)S(=O)(=O)Nc1cnc(Cl)cn1
InChIInChI=1S/C8H13ClN4O2S/c1-3-13(4-2)16(14,15)12-8-6-10-7(9)5-11-8/h5-6H,3-4H2,1-2H3,(H,11,12)
InChIKeyLACUHSZDFNIAOJ-UHFFFAOYSA-N
XLogP1.13
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.74
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(diethylsulfamoylamino)pyrazine?
The IUPAC name of 2-chloro-5-(diethylsulfamoylamino)pyrazine (CID 107596039) is 2-chloro-5-(diethylsulfamoylamino)pyrazine.
What is the SMILES notation for 2-chloro-5-(diethylsulfamoylamino)pyrazine?
The canonical SMILES for 2-chloro-5-(diethylsulfamoylamino)pyrazine is CCN(CC)S(=O)(=O)Nc1cnc(Cl)cn1.
What is the InChIKey of 2-chloro-5-(diethylsulfamoylamino)pyrazine?
The InChIKey is LACUHSZDFNIAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13ClN4O2S/c1-3-13(4-2)16(14,15)12-8-6-10-7(9)5-11-8/h5-6H,3-4H2,1-2H3,(H,11,12).
What are the key properties of 2-chloro-5-(diethylsulfamoylamino)pyrazine?
2-chloro-5-(diethylsulfamoylamino)pyrazine has a molecular weight of 264.74 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(diethylsulfamoylamino)pyrazine is sourced from PubChem (CID 107596039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).