6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine

C16H20N4 — CID 80760259

IUPAC6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine
SMILESCCNc1cncc(Nc2cccc3c2CCCC3)n1
InChIInChI=1S/C16H20N4/c1-2-18-15-10-17-11-16(20-15)19-14-9-5-7-12-6-3-4-8-13(12)14/h5,7,9-11H,2-4,6,8H2,1H3,(H2,18,19,20)
InChIKeySGWNJOWYYQXYBD-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.53
Rot. Bonds4

About 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine

6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine (PubChem CID 80760259) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine
PubChem CID80760259
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine
SMILESCCNc1cncc(Nc2cccc3c2CCCC3)n1
InChIInChI=1S/C16H20N4/c1-2-18-15-10-17-11-16(20-15)19-14-9-5-7-12-6-3-4-8-13(12)14/h5,7,9-11H,2-4,6,8H2,1H3,(H2,18,19,20)
InChIKeySGWNJOWYYQXYBD-UHFFFAOYSA-N
XLogP3.53
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine (CID 80760259) is 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine is CCNc1cncc(Nc2cccc3c2CCCC3)n1.
What is the InChIKey of 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine?
The InChIKey is SGWNJOWYYQXYBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-2-18-15-10-17-11-16(20-15)19-14-9-5-7-12-6-3-4-8-13(12)14/h5,7,9-11H,2-4,6,8H2,1H3,(H2,18,19,20).
What are the key properties of 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine?
6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine has a molecular weight of 268.36 g/mol, XLogP of 3.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrazine-2,6-diamine is sourced from PubChem (CID 80760259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).