3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine

C16H12N4OS — CID 155552822

IUPAC3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine
SMILESCOc1ccc(-c2cnc3cnc(-c4ccsc4)cn23)cn1
InChIInChI=1S/C16H12N4OS/c1-21-16-3-2-11(6-19-16)14-7-18-15-8-17-13(9-20(14)15)12-4-5-22-10-12/h2-10H,1H3
InChIKeyYAZRRJYADDWLPW-UHFFFAOYSA-N
MW308.37 g/mol
LogP3.53
Rot. Bonds3

About 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine

3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine (PubChem CID 155552822) has the molecular formula C16H12N4OS and a molecular weight of 308.37 g/mol. Its IUPAC name is 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine
PubChem CID155552822
Molecular FormulaC16H12N4OS
Molecular Weight308.37 g/mol
Exact Mass308.07
IUPAC Name3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine
SMILESCOc1ccc(-c2cnc3cnc(-c4ccsc4)cn23)cn1
InChIInChI=1S/C16H12N4OS/c1-21-16-3-2-11(6-19-16)14-7-18-15-8-17-13(9-20(14)15)12-4-5-22-10-12/h2-10H,1H3
InChIKeyYAZRRJYADDWLPW-UHFFFAOYSA-N
XLogP3.53
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.37
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine?
The IUPAC name of 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine (CID 155552822) is 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine?
The canonical SMILES for 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine is COc1ccc(-c2cnc3cnc(-c4ccsc4)cn23)cn1.
What is the InChIKey of 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine?
The InChIKey is YAZRRJYADDWLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4OS/c1-21-16-3-2-11(6-19-16)14-7-18-15-8-17-13(9-20(14)15)12-4-5-22-10-12/h2-10H,1H3.
What are the key properties of 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine?
3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine has a molecular weight of 308.37 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-3-pyridinyl)-6-thiophen-3-ylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 155552822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).