6-(6-fluoro-2-methylimidazo[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

C38H30F8N10 — CID 159805438

IUPAC6-(6-fluoro-2-methylimidazo[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
SMILESCc1nc2ccc(F)cn2c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2n(c1-c1cncc(Nc3ccc(C(F)(F)F)cc3)n1)CC(F)CC2
InChIInChI=1S/C19H17F4N5.C19H13F4N5/c2*1-11-18(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);2-10H,1H3,(H,26,27)
InChIKeyNKIDTEKIFSLAMA-UHFFFAOYSA-N
MW778.71 g/mol
LogP9.70
Rot. Bonds6

About 6-(6-fluoro-2-methylimidazo[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

6-(6-fluoro-2-methylimidazo[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 159805438) has the molecular formula C38H30F8N10 and a molecular weight of 778.71 g/mol. Its IUPAC name is 6-(6-fluoro-2-methylimidazo[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.

Molecular Properties

Compound Name6-(6-fluoro-2-methylimidazo[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 CID159805438
Molecular FormulaC38H30F8N10
Molecular Weight778.71 g/mol
Exact Mass778.25
IUPAC Name6-(6-fluoro-2-methylimidazo[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
SMILESCc1nc2ccc(F)cn2c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2n(c1-c1cncc(Nc3ccc(C(F)(F)F)cc3)n1)CC(F)CC2
InChIInChI=1S/C19H17F4N5.C19H13F4N5/c2*1-11-18(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);2-10H,1H3,(H,26,27)
InChIKeyNKIDTEKIFSLAMA-UHFFFAOYSA-N
XLogP9.70
TPSA110.74 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms56
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500778.71
LogP ≤ 59.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 6-(6-fluoro-2-methylimidazo[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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(6-fluoro-2-methylimidazo[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?
The IUPAC name of 6-(6-fluoro-2-methylimidazo[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 (CID 159805438) is 6-(6-fluoro-2-methylimidazo[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.
What is the SMILES notation for 6-(6-fluoro-2-methylimidazo[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?
The canonical SMILES for 6-(6-fluoro-2-methylimidazo[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 is Cc1nc2ccc(F)cn2c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2n(c1-c1cncc(Nc3ccc(C(F)(F)F)cc3)n1)CC(F)CC2.
What is the InChIKey of 6-(6-fluoro-2-methylimidazo[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?
The InChIKey is NKIDTEKIFSLAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F4N5.C19H13F4N5/c2*1-11-18(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);2-10H,1H3,(H,26,27).
What are the key properties of 6-(6-fluoro-2-methylimidazo[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?
6-(6-fluoro-2-methylimidazo[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 778.71 g/mol, XLogP of 9.70, 6 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-fluoro-2-methylimidazo[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 is sourced from PubChem (CID 159805438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).