3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine

C11H15N3 — CID 130986112

IUPAC3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine
SMILESc1cc2c(cn1)NC(C1CCC1)CN2
InChIInChI=1S/C11H15N3/c1-2-8(3-1)10-7-13-9-4-5-12-6-11(9)14-10/h4-6,8,10,13-14H,1-3,7H2
InChIKeyQWVUCEBQEOIPNZ-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.09
Rot. Bonds1

About 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine

3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine (PubChem CID 130986112) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine.

Molecular Properties

Compound Name3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine
PubChem CID130986112
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine
SMILESc1cc2c(cn1)NC(C1CCC1)CN2
InChIInChI=1S/C11H15N3/c1-2-8(3-1)10-7-13-9-4-5-12-6-11(9)14-10/h4-6,8,10,13-14H,1-3,7H2
InChIKeyQWVUCEBQEOIPNZ-UHFFFAOYSA-N
XLogP2.09
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine?
The IUPAC name of 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine (CID 130986112) is 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine.
What is the SMILES notation for 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine?
The canonical SMILES for 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine is c1cc2c(cn1)NC(C1CCC1)CN2.
What is the InChIKey of 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine?
The InChIKey is QWVUCEBQEOIPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-2-8(3-1)10-7-13-9-4-5-12-6-11(9)14-10/h4-6,8,10,13-14H,1-3,7H2.
What are the key properties of 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine?
3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine has a molecular weight of 189.26 g/mol, XLogP of 2.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1,2,3,4-tetrahydropyrido[3,4-b]pyrazine is sourced from PubChem (CID 130986112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).