2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine

C12H22N4O — CID 80808373

IUPAC2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(N(CC)CCOC)n1
InChIInChI=1S/C12H22N4O/c1-4-6-14-11-9-13-10-12(15-11)16(5-2)7-8-17-3/h9-10H,4-8H2,1-3H3,(H,14,15)
InChIKeyOGNABZKFSXGJSV-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.77
Rot. Bonds8

About 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine

2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine (PubChem CID 80808373) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine
PubChem CID80808373
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(N(CC)CCOC)n1
InChIInChI=1S/C12H22N4O/c1-4-6-14-11-9-13-10-12(15-11)16(5-2)7-8-17-3/h9-10H,4-8H2,1-3H3,(H,14,15)
InChIKeyOGNABZKFSXGJSV-UHFFFAOYSA-N
XLogP1.77
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine?
The IUPAC name of 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine (CID 80808373) is 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine is CCCNc1cncc(N(CC)CCOC)n1.
What is the InChIKey of 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine?
The InChIKey is OGNABZKFSXGJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-4-6-14-11-9-13-10-12(15-11)16(5-2)7-8-17-3/h9-10H,4-8H2,1-3H3,(H,14,15).
What are the key properties of 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine?
2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine has a molecular weight of 238.33 g/mol, XLogP of 1.77, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine is sourced from PubChem (CID 80808373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).