N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide

C15H23N5O4S — CID 118765190

IUPACN-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1nccnc1C(=O)N1CCCCC1
InChIInChI=1S/C15H23N5O4S/c1-19(2)25(23,24)11-8-18-14(21)12-13(17-7-6-16-12)15(22)20-9-4-3-5-10-20/h6-7H,3-5,8-11H2,1-2H3,(H,18,21)
InChIKeyHQSBUZRHIUUIIQ-UHFFFAOYSA-N
MW369.45 g/mol
LogP-0.28
Rot. Bonds6

About N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide

N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide (PubChem CID 118765190) has the molecular formula C15H23N5O4S and a molecular weight of 369.45 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide
PubChem CID118765190
Molecular FormulaC15H23N5O4S
Molecular Weight369.45 g/mol
Exact Mass369.15
IUPAC NameN-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1nccnc1C(=O)N1CCCCC1
InChIInChI=1S/C15H23N5O4S/c1-19(2)25(23,24)11-8-18-14(21)12-13(17-7-6-16-12)15(22)20-9-4-3-5-10-20/h6-7H,3-5,8-11H2,1-2H3,(H,18,21)
InChIKeyHQSBUZRHIUUIIQ-UHFFFAOYSA-N
XLogP-0.28
TPSA112.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide?
The IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide (CID 118765190) is N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide is CN(C)S(=O)(=O)CCNC(=O)c1nccnc1C(=O)N1CCCCC1.
What is the InChIKey of N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide?
The InChIKey is HQSBUZRHIUUIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O4S/c1-19(2)25(23,24)11-8-18-14(21)12-13(17-7-6-16-12)15(22)20-9-4-3-5-10-20/h6-7H,3-5,8-11H2,1-2H3,(H,18,21).
What are the key properties of N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide?
N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide has a molecular weight of 369.45 g/mol, XLogP of -0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylsulfamoyl)ethyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide is sourced from PubChem (CID 118765190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).