N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide

C19H14F2N6O2 — CID 59251736

IUPACN-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1cn2cc(-c3cnc(N)c(Oc4cccc(F)c4)n3)cc(F)c2n1
InChIInChI=1S/C19H14F2N6O2/c1-10(28)24-16-9-27-8-11(5-14(21)18(27)26-16)15-7-23-17(22)19(25-15)29-13-4-2-3-12(20)6-13/h2-9H,1H3,(H2,22,23)(H,24,28)
InChIKeyXMRWIDLZDOELNV-UHFFFAOYSA-N
MW396.36 g/mol
LogP3.40
Rot. Bonds4

About N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide

N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide (PubChem CID 59251736) has the molecular formula C19H14F2N6O2 and a molecular weight of 396.36 g/mol. Its IUPAC name is N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide
PubChem CID59251736
Molecular FormulaC19H14F2N6O2
Molecular Weight396.36 g/mol
Exact Mass396.11
IUPAC NameN-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1cn2cc(-c3cnc(N)c(Oc4cccc(F)c4)n3)cc(F)c2n1
InChIInChI=1S/C19H14F2N6O2/c1-10(28)24-16-9-27-8-11(5-14(21)18(27)26-16)15-7-23-17(22)19(25-15)29-13-4-2-3-12(20)6-13/h2-9H,1H3,(H2,22,23)(H,24,28)
InChIKeyXMRWIDLZDOELNV-UHFFFAOYSA-N
XLogP3.40
TPSA107.43 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.36
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide?
The IUPAC name of N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide (CID 59251736) is N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide?
The canonical SMILES for N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide is CC(=O)Nc1cn2cc(-c3cnc(N)c(Oc4cccc(F)c4)n3)cc(F)c2n1.
What is the InChIKey of N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide?
The InChIKey is XMRWIDLZDOELNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N6O2/c1-10(28)24-16-9-27-8-11(5-14(21)18(27)26-16)15-7-23-17(22)19(25-15)29-13-4-2-3-12(20)6-13/h2-9H,1H3,(H2,22,23)(H,24,28).
What are the key properties of N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide?
N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide has a molecular weight of 396.36 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[5-amino-6-(3-fluorophenoxy)pyrazin-2-yl]-8-fluoroimidazo[1,2-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 59251736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).