6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide

C13H21N5OS — CID 106327146

IUPAC6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESCCNc1cncc(C(=O)NCCN2CCSCC2)n1
InChIInChI=1S/C13H21N5OS/c1-2-15-12-10-14-9-11(17-12)13(19)16-3-4-18-5-7-20-8-6-18/h9-10H,2-8H2,1H3,(H,15,17)(H,16,19)
InChIKeySCFZUCFQOIRTML-UHFFFAOYSA-N
MW295.41 g/mol
LogP0.69
Rot. Bonds6

About 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide

6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide (PubChem CID 106327146) has the molecular formula C13H21N5OS and a molecular weight of 295.41 g/mol. Its IUPAC name is 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide
PubChem CID106327146
Molecular FormulaC13H21N5OS
Molecular Weight295.41 g/mol
Exact Mass295.15
IUPAC Name6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESCCNc1cncc(C(=O)NCCN2CCSCC2)n1
InChIInChI=1S/C13H21N5OS/c1-2-15-12-10-14-9-11(17-12)13(19)16-3-4-18-5-7-20-8-6-18/h9-10H,2-8H2,1H3,(H,15,17)(H,16,19)
InChIKeySCFZUCFQOIRTML-UHFFFAOYSA-N
XLogP0.69
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide
CID 106327192
6-(ethylamino)-N-hexylpyrazine-2-carboxamide
CID 114035955
4-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-3-carboxamide
CID 106327044
N-(3-cyclopropylpropyl)-6-(ethylamino)pyrazine-2-carboxamide
CID 114036099
6-N-methyl-2-N-(2-thiomorpholin-4-ylethyl)pyrazine-2,6-diamine
CID 114174033
5-chloro-6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-3-carboxamide
CID 106327037
6-(ethylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyrazine-2-carboxamide
CID 106050219
N-ethyl-6-thiomorpholin-4-ylpyrazin-2-amine
CID 78990525
6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine
CID 78990309
5-chloro-2-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)benzamide
CID 103529940
6-(ethylamino)-N-(2-methylbutan-2-yl)pyrazine-2-carboxamide
CID 114035629
2-ethyl-6-hydrazinyl-N-(2-thiomorpholin-4-ylethyl)pyridine-4-carboxamide
CID 106327211

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide?
The IUPAC name of 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide (CID 106327146) is 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide is CCNc1cncc(C(=O)NCCN2CCSCC2)n1.
What is the InChIKey of 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide?
The InChIKey is SCFZUCFQOIRTML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5OS/c1-2-15-12-10-14-9-11(17-12)13(19)16-3-4-18-5-7-20-8-6-18/h9-10H,2-8H2,1H3,(H,15,17)(H,16,19).
What are the key properties of 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide?
6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide has a molecular weight of 295.41 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 106327146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).