6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine

C24H18F2N4O — CID 67004625

IUPAC6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
SMILESCc1ncc(-c2ccc(Nc3cc(F)cn4cc(-c5ccc(F)cc5C)nc34)cc2)o1
InChIInChI=1S/C24H18F2N4O/c1-14-9-17(25)5-8-20(14)22-13-30-12-18(26)10-21(24(30)29-22)28-19-6-3-16(4-7-19)23-11-27-15(2)31-23/h3-13,28H,1-2H3
InChIKeyGSSDWJVSJLLGLG-UHFFFAOYSA-N
MW416.43 g/mol
LogP6.29
Rot. Bonds4

About 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine

6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine (PubChem CID 67004625) has the molecular formula C24H18F2N4O and a molecular weight of 416.43 g/mol. Its IUPAC name is 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine.

Molecular Properties

Compound Name6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
PubChem CID67004625
Molecular FormulaC24H18F2N4O
Molecular Weight416.43 g/mol
Exact Mass416.14
IUPAC Name6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
SMILESCc1ncc(-c2ccc(Nc3cc(F)cn4cc(-c5ccc(F)cc5C)nc34)cc2)o1
InChIInChI=1S/C24H18F2N4O/c1-14-9-17(25)5-8-20(14)22-13-30-12-18(26)10-21(24(30)29-22)28-19-6-3-16(4-7-19)23-11-27-15(2)31-23/h3-13,28H,1-2H3
InChIKeyGSSDWJVSJLLGLG-UHFFFAOYSA-N
XLogP6.29
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.43
LogP ≤ 56.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
The IUPAC name of 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine (CID 67004625) is 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine.
What is the SMILES notation for 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
The canonical SMILES for 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine is Cc1ncc(-c2ccc(Nc3cc(F)cn4cc(-c5ccc(F)cc5C)nc34)cc2)o1.
What is the InChIKey of 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
The InChIKey is GSSDWJVSJLLGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F2N4O/c1-14-9-17(25)5-8-20(14)22-13-30-12-18(26)10-21(24(30)29-22)28-19-6-3-16(4-7-19)23-11-27-15(2)31-23/h3-13,28H,1-2H3.
What are the key properties of 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine?
6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine has a molecular weight of 416.43 g/mol, XLogP of 6.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(4-fluoro-2-methylphenyl)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 67004625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).