7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine

C7H4F3N3S — CID 169004291

IUPAC7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine
SMILESFC(F)(F)Sc1cc2nccn2cn1
InChIInChI=1S/C7H4F3N3S/c8-7(9,10)14-6-3-5-11-1-2-13(5)4-12-6/h1-4H
InChIKeyNBDNNWOTTYLVGF-UHFFFAOYSA-N
MW219.19 g/mol
LogP2.34
Rot. Bonds1

About 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine

7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine (PubChem CID 169004291) has the molecular formula C7H4F3N3S and a molecular weight of 219.19 g/mol. Its IUPAC name is 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine
PubChem CID169004291
Molecular FormulaC7H4F3N3S
Molecular Weight219.19 g/mol
Exact Mass219.01
IUPAC Name7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine
SMILESFC(F)(F)Sc1cc2nccn2cn1
InChIInChI=1S/C7H4F3N3S/c8-7(9,10)14-6-3-5-11-1-2-13(5)4-12-6/h1-4H
InChIKeyNBDNNWOTTYLVGF-UHFFFAOYSA-N
XLogP2.34
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.19
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine?
The IUPAC name of 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine (CID 169004291) is 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine.
What is the SMILES notation for 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine?
The canonical SMILES for 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine is FC(F)(F)Sc1cc2nccn2cn1.
What is the InChIKey of 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine?
The InChIKey is NBDNNWOTTYLVGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F3N3S/c8-7(9,10)14-6-3-5-11-1-2-13(5)4-12-6/h1-4H.
What are the key properties of 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine?
7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine has a molecular weight of 219.19 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethylsulfanyl)imidazo[1,2-c]pyrimidine is sourced from PubChem (CID 169004291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).