6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine

C11H11N3 — CID 138978263

IUPAC6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine
SMILESCC1=C(c2cn3ccnc3cn2)CC1
InChIInChI=1S/C11H11N3/c1-8-2-3-9(8)10-7-14-5-4-12-11(14)6-13-10/h4-7H,2-3H2,1H3
InChIKeyAKLQLNHNIFRCPR-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.30
Rot. Bonds1

About 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine

6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine (PubChem CID 138978263) has the molecular formula C11H11N3 and a molecular weight of 185.23 g/mol. Its IUPAC name is 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine
PubChem CID138978263
Molecular FormulaC11H11N3
Molecular Weight185.23 g/mol
Exact Mass185.10
IUPAC Name6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine
SMILESCC1=C(c2cn3ccnc3cn2)CC1
InChIInChI=1S/C11H11N3/c1-8-2-3-9(8)10-7-14-5-4-12-11(14)6-13-10/h4-7H,2-3H2,1H3
InChIKeyAKLQLNHNIFRCPR-UHFFFAOYSA-N
XLogP2.30
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine (CID 138978263) is 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine is CC1=C(c2cn3ccnc3cn2)CC1.
What is the InChIKey of 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine?
The InChIKey is AKLQLNHNIFRCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3/c1-8-2-3-9(8)10-7-14-5-4-12-11(14)6-13-10/h4-7H,2-3H2,1H3.
What are the key properties of 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine?
6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine has a molecular weight of 185.23 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylcyclobuten-1-yl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 138978263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).