6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

C19H17F4N5 — CID 122578372

IUPAC6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
SMILESCc1nc2n(c1-c1cncc(Nc3ccc(C(F)(F)F)cc3)n1)CC(F)CC2
InChIInChI=1S/C19H17F4N5/c1-11-18(28-10-13(20)4-7-17(28)25-11)15-8-24-9-16(27-15)26-14-5-2-12(3-6-14)19(21,22)23/h2-3,5-6,8-9,13H,4,7,10H2,1H3,(H,26,27)
InChIKeyJUUNEGSPORUUQL-UHFFFAOYSA-N
MW391.37 g/mol
LogP4.70
Rot. Bonds3

About 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine

6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine (PubChem CID 122578372) has the molecular formula C19H17F4N5 and a molecular weight of 391.37 g/mol. Its IUPAC name is 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
PubChem CID122578372
Molecular FormulaC19H17F4N5
Molecular Weight391.37 g/mol
Exact Mass391.14
IUPAC Name6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
SMILESCc1nc2n(c1-c1cncc(Nc3ccc(C(F)(F)F)cc3)n1)CC(F)CC2
InChIInChI=1S/C19H17F4N5/c1-11-18(28-10-13(20)4-7-17(28)25-11)15-8-24-9-16(27-15)26-14-5-2-12(3-6-14)19(21,22)23/h2-3,5-6,8-9,13H,4,7,10H2,1H3,(H,26,27)
InChIKeyJUUNEGSPORUUQL-UHFFFAOYSA-N
XLogP4.70
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.37
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
The IUPAC name of 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine (CID 122578372) is 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine.
What is the SMILES notation for 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
The canonical SMILES for 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine is Cc1nc2n(c1-c1cncc(Nc3ccc(C(F)(F)F)cc3)n1)CC(F)CC2.
What is the InChIKey of 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
The InChIKey is JUUNEGSPORUUQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F4N5/c1-11-18(28-10-13(20)4-7-17(28)25-11)15-8-24-9-16(27-15)26-14-5-2-12(3-6-14)19(21,22)23/h2-3,5-6,8-9,13H,4,7,10H2,1H3,(H,26,27).
What are the key properties of 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine?
6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine has a molecular weight of 391.37 g/mol, XLogP of 4.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-fluoro-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine is sourced from PubChem (CID 122578372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).