2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone

C23H20FN5O2 — CID 131681880

IUPAC2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone
SMILESO=C(Cc1ccc(F)cn1)N1CCOC(c2ncn3cc(-c4ccncc4)ccc23)C1
InChIInChI=1S/C23H20FN5O2/c24-18-2-3-19(26-12-18)11-22(30)28-9-10-31-21(14-28)23-20-4-1-17(13-29(20)15-27-23)16-5-7-25-8-6-16/h1-8,12-13,15,21H,9-11,14H2
InChIKeyFAVFLCBSIJTLOA-UHFFFAOYSA-N
MW417.44 g/mol
LogP3.07
Rot. Bonds4

About 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone

2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone (PubChem CID 131681880) has the molecular formula C23H20FN5O2 and a molecular weight of 417.44 g/mol. Its IUPAC name is 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone
PubChem CID131681880
Molecular FormulaC23H20FN5O2
Molecular Weight417.44 g/mol
Exact Mass417.16
IUPAC Name2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone
SMILESO=C(Cc1ccc(F)cn1)N1CCOC(c2ncn3cc(-c4ccncc4)ccc23)C1
InChIInChI=1S/C23H20FN5O2/c24-18-2-3-19(26-12-18)11-22(30)28-9-10-31-21(14-28)23-20-4-1-17(13-29(20)15-27-23)16-5-7-25-8-6-16/h1-8,12-13,15,21H,9-11,14H2
InChIKeyFAVFLCBSIJTLOA-UHFFFAOYSA-N
XLogP3.07
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.44
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(E)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]-3-thiophen-2-ylprop-2-en-1-one
CID 131687509
2-(3-fluorophenyl)-1-(2-pyridin-4-ylmorpholin-4-yl)ethanone
CID 155983401
1-(2-pyridin-4-ylmorpholin-4-yl)-2-thiophen-3-ylethanone
CID 110102530
1-(2-phenylmorpholin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanone
CID 134040035
2-(4-fluorophenyl)-1-[2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]morpholin-4-yl]ethanone
CID 142778838
2-(4-fluorophenyl)-1-[2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone
CID 110112932
2-(4-methylphenyl)-1-[4-methyl-3-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)piperazin-1-yl]ethanone
CID 131673414
2-chloro-1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 51889846
1-[(3R)-3-[3-(4-fluorophenyl)pyrazin-2-yl]piperidin-1-yl]-2-pyridin-4-ylethanone
CID 95819071
1-[(2R,3aS,7aS)-2-(1,2-oxazolidine-2-carbonyl)-3,3a,4,5,7,7a-hexahydro-2H-furo[2,3-c]pyridin-6-yl]-2-(5-fluoro-2-pyridinyl)ethanone
CID 131683056
1-[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-2-(2-fluorophenyl)ethanone
CID 125015943
(4-methylphenyl)-[2-(6-pyridin-4-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone;2,2,2-trifluoroacetic acid
CID 155852687

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone?
The IUPAC name of 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone (CID 131681880) is 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone is O=C(Cc1ccc(F)cn1)N1CCOC(c2ncn3cc(-c4ccncc4)ccc23)C1.
What is the InChIKey of 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone?
The InChIKey is FAVFLCBSIJTLOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FN5O2/c24-18-2-3-19(26-12-18)11-22(30)28-9-10-31-21(14-28)23-20-4-1-17(13-29(20)15-27-23)16-5-7-25-8-6-16/h1-8,12-13,15,21H,9-11,14H2.
What are the key properties of 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone?
2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone has a molecular weight of 417.44 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-pyridinyl)-1-[2-(6-pyridin-4-ylimidazo[1,5-a]pyridin-1-yl)morpholin-4-yl]ethanone is sourced from PubChem (CID 131681880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).