3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine

C10H9F2N3 — CID 139530432

IUPAC3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine
SMILESFC1(F)CC(c2ncc3cnccn23)C1
InChIInChI=1S/C10H9F2N3/c11-10(12)3-7(4-10)9-14-6-8-5-13-1-2-15(8)9/h1-2,5-7H,3-4H2
InChIKeyNITBKMAYTPAESG-UHFFFAOYSA-N
MW209.20 g/mol
LogP2.24
Rot. Bonds1

About 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine

3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine (PubChem CID 139530432) has the molecular formula C10H9F2N3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine
PubChem CID139530432
Molecular FormulaC10H9F2N3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine
SMILESFC1(F)CC(c2ncc3cnccn23)C1
InChIInChI=1S/C10H9F2N3/c11-10(12)3-7(4-10)9-14-6-8-5-13-1-2-15(8)9/h1-2,5-7H,3-4H2
InChIKeyNITBKMAYTPAESG-UHFFFAOYSA-N
XLogP2.24
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine?
The IUPAC name of 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine (CID 139530432) is 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine is FC1(F)CC(c2ncc3cnccn23)C1.
What is the InChIKey of 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine?
The InChIKey is NITBKMAYTPAESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3/c11-10(12)3-7(4-10)9-14-6-8-5-13-1-2-15(8)9/h1-2,5-7H,3-4H2.
What are the key properties of 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine?
3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine has a molecular weight of 209.20 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,3-difluorocyclobutyl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 139530432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).