6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine

C11H11ClF2N4 — CID 170783967

IUPAC6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine
SMILESFC1(F)CCN(c2nc(Cl)cn3cncc23)CC1
InChIInChI=1S/C11H11ClF2N4/c12-9-6-18-7-15-5-8(18)10(16-9)17-3-1-11(13,14)2-4-17/h5-7H,1-4H2
InChIKeyVAGYTXCBBGQQBA-UHFFFAOYSA-N
MW272.69 g/mol
LogP2.62
Rot. Bonds1

About 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine

6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine (PubChem CID 170783967) has the molecular formula C11H11ClF2N4 and a molecular weight of 272.69 g/mol. Its IUPAC name is 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine
PubChem CID170783967
Molecular FormulaC11H11ClF2N4
Molecular Weight272.69 g/mol
Exact Mass272.06
IUPAC Name6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine
SMILESFC1(F)CCN(c2nc(Cl)cn3cncc23)CC1
InChIInChI=1S/C11H11ClF2N4/c12-9-6-18-7-15-5-8(18)10(16-9)17-3-1-11(13,14)2-4-17/h5-7H,1-4H2
InChIKeyVAGYTXCBBGQQBA-UHFFFAOYSA-N
XLogP2.62
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine?
The IUPAC name of 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine (CID 170783967) is 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine is FC1(F)CCN(c2nc(Cl)cn3cncc23)CC1.
What is the InChIKey of 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine?
The InChIKey is VAGYTXCBBGQQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClF2N4/c12-9-6-18-7-15-5-8(18)10(16-9)17-3-1-11(13,14)2-4-17/h5-7H,1-4H2.
What are the key properties of 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine?
6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine has a molecular weight of 272.69 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-8-(4,4-difluoropiperidin-1-yl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 170783967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).