3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine

C11H12FN3O — CID 122652403

IUPAC3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine
SMILESCOc1nc(C)cn2c(C3CC3F)ncc12
InChIInChI=1S/C11H12FN3O/c1-6-5-15-9(11(14-6)16-2)4-13-10(15)7-3-8(7)12/h4-5,7-8H,3H2,1-2H3
InChIKeyCYNCBSDMZPJQIA-UHFFFAOYSA-N
MW221.23 g/mol
LogP1.87
Rot. Bonds2

About 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine

3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine (PubChem CID 122652403) has the molecular formula C11H12FN3O and a molecular weight of 221.23 g/mol. Its IUPAC name is 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine
PubChem CID122652403
Molecular FormulaC11H12FN3O
Molecular Weight221.23 g/mol
Exact Mass221.10
IUPAC Name3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine
SMILESCOc1nc(C)cn2c(C3CC3F)ncc12
InChIInChI=1S/C11H12FN3O/c1-6-5-15-9(11(14-6)16-2)4-13-10(15)7-3-8(7)12/h4-5,7-8H,3H2,1-2H3
InChIKeyCYNCBSDMZPJQIA-UHFFFAOYSA-N
XLogP1.87
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.23
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine?
The IUPAC name of 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine (CID 122652403) is 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine.
What is the SMILES notation for 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine?
The canonical SMILES for 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine is COc1nc(C)cn2c(C3CC3F)ncc12.
What is the InChIKey of 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine?
The InChIKey is CYNCBSDMZPJQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-6-5-15-9(11(14-6)16-2)4-13-10(15)7-3-8(7)12/h4-5,7-8H,3H2,1-2H3.
What are the key properties of 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine?
3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine has a molecular weight of 221.23 g/mol, XLogP of 1.87, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorocyclopropyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine is sourced from PubChem (CID 122652403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).