3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine

C10H16N2 — CID 121215693

IUPAC3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine
SMILESCCC1=NC2CCCC2N=C1C
InChIInChI=1S/C10H16N2/c1-3-8-7(2)11-9-5-4-6-10(9)12-8/h9-10H,3-6H2,1-2H3
InChIKeyWKUQBVKQSWWDHH-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.23
Rot. Bonds1

About 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine

3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine (PubChem CID 121215693) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine.

Molecular Properties

Compound Name3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine
PubChem CID121215693
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine
SMILESCCC1=NC2CCCC2N=C1C
InChIInChI=1S/C10H16N2/c1-3-8-7(2)11-9-5-4-6-10(9)12-8/h9-10H,3-6H2,1-2H3
InChIKeyWKUQBVKQSWWDHH-UHFFFAOYSA-N
XLogP2.23
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine?
The IUPAC name of 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine (CID 121215693) is 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine.
What is the SMILES notation for 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine?
The canonical SMILES for 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine is CCC1=NC2CCCC2N=C1C.
What is the InChIKey of 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine?
The InChIKey is WKUQBVKQSWWDHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-8-7(2)11-9-5-4-6-10(9)12-8/h9-10H,3-6H2,1-2H3.
What are the key properties of 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine?
3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine has a molecular weight of 164.25 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyrazine is sourced from PubChem (CID 121215693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).