6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine

C7H3ClF3N3 — CID 134543537

IUPAC6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine
SMILESFC(F)(F)c1ncc2cnc(Cl)cn12
InChIInChI=1S/C7H3ClF3N3/c8-5-3-14-4(1-12-5)2-13-6(14)7(9,10)11/h1-3H
InChIKeyCEPGNYNIRHDKLJ-UHFFFAOYSA-N
MW221.57 g/mol
LogP2.40
Rot. Bonds

About 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine

6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine (PubChem CID 134543537) has the molecular formula C7H3ClF3N3 and a molecular weight of 221.57 g/mol. Its IUPAC name is 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine
PubChem CID134543537
Molecular FormulaC7H3ClF3N3
Molecular Weight221.57 g/mol
Exact Mass221.00
IUPAC Name6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine
SMILESFC(F)(F)c1ncc2cnc(Cl)cn12
InChIInChI=1S/C7H3ClF3N3/c8-5-3-14-4(1-12-5)2-13-6(14)7(9,10)11/h1-3H
InChIKeyCEPGNYNIRHDKLJ-UHFFFAOYSA-N
XLogP2.40
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.57
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Imidazo(1,5-a)pyrazin-8-amine
CID 55276043
Imidazo(1,5-a)pyrazine
CID 292283
2-(Chloromethyl)imidazo[1,2-a]pyrimidine
CID 1417908
8-Chloro-3-methylimidazo(1,5-a)pyrazine
CID 12240476
1-Chloro-3-methylimidazo[1,5-a]pyrazine
CID 293611
8-Chloroimidazo[1,5-a]pyrazine
CID 12240475
3-Chloroimidazo[1,2-a]pyrimidine
CID 15179743
3-(Trifluoromethyl)imidazo[1,5-a]pyrazine
CID 34176321
3-Bromo-8-chloro-1-iodoimidazo[1,5-A]pyrazine
CID 71743089
5-Bromo-8-chloroimidazo(1,5-a)pyrazine
CID 76849750
3-Bromo-8-chloroimidazo(1,5-a)pyrazine
CID 83382723
6-Chloroimidazo[1,5-a]pyrazine
CID 130847064

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine?
The IUPAC name of 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine (CID 134543537) is 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine is FC(F)(F)c1ncc2cnc(Cl)cn12.
What is the InChIKey of 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine?
The InChIKey is CEPGNYNIRHDKLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3ClF3N3/c8-5-3-14-4(1-12-5)2-13-6(14)7(9,10)11/h1-3H.
What are the key properties of 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine?
6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine has a molecular weight of 221.57 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(trifluoromethyl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 134543537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).