6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine

C19H14F3N5O — CID 118094659

IUPAC6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine
SMILESCOc1ccc2nc(C(F)(F)F)c(-c3cncc(Nc4ccccc4)n3)n2c1
InChIInChI=1S/C19H14F3N5O/c1-28-13-7-8-16-26-18(19(20,21)22)17(27(16)11-13)14-9-23-10-15(25-14)24-12-5-3-2-4-6-12/h2-11H,1H3,(H,24,25)
InChIKeySJKMCDDUGZATEQ-UHFFFAOYSA-N
MW385.35 g/mol
LogP4.56
Rot. Bonds4

About 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine

6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine (PubChem CID 118094659) has the molecular formula C19H14F3N5O and a molecular weight of 385.35 g/mol. Its IUPAC name is 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine.

Molecular Properties

Compound Name6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine
PubChem CID118094659
Molecular FormulaC19H14F3N5O
Molecular Weight385.35 g/mol
Exact Mass385.12
IUPAC Name6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine
SMILESCOc1ccc2nc(C(F)(F)F)c(-c3cncc(Nc4ccccc4)n3)n2c1
InChIInChI=1S/C19H14F3N5O/c1-28-13-7-8-16-26-18(19(20,21)22)17(27(16)11-13)14-9-23-10-15(25-14)24-12-5-3-2-4-6-12/h2-11H,1H3,(H,24,25)
InChIKeySJKMCDDUGZATEQ-UHFFFAOYSA-N
XLogP4.56
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.35
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine?
The IUPAC name of 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine (CID 118094659) is 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine.
What is the SMILES notation for 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine?
The canonical SMILES for 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine is COc1ccc2nc(C(F)(F)F)c(-c3cncc(Nc4ccccc4)n3)n2c1.
What is the InChIKey of 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine?
The InChIKey is SJKMCDDUGZATEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N5O/c1-28-13-7-8-16-26-18(19(20,21)22)17(27(16)11-13)14-9-23-10-15(25-14)24-12-5-3-2-4-6-12/h2-11H,1H3,(H,24,25).
What are the key properties of 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine?
6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine has a molecular weight of 385.35 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine is sourced from PubChem (CID 118094659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).