2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone

C26H26FN5O2 — CID 158609266

IUPAC2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
SMILESCC(C)N1CCC(c2nc(C(=O)Cc3cc4nc(-c5cncc(F)c5)ccc4cn3)co2)CC1
InChIInChI=1S/C26H26FN5O2/c1-16(2)32-7-5-17(6-8-32)26-31-24(15-34-26)25(33)11-21-10-23-18(13-29-21)3-4-22(30-23)19-9-20(27)14-28-12-19/h3-4,9-10,12-17H,5-8,11H2,1-2H3
InChIKeyHWPXHMIRLBFVFD-UHFFFAOYSA-N
MW459.53 g/mol
LogP4.83
Rot. Bonds6

About 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone

2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone (PubChem CID 158609266) has the molecular formula C26H26FN5O2 and a molecular weight of 459.53 g/mol. Its IUPAC name is 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone.

Molecular Properties

Compound Name2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
PubChem CID158609266
Molecular FormulaC26H26FN5O2
Molecular Weight459.53 g/mol
Exact Mass459.21
IUPAC Name2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
SMILESCC(C)N1CCC(c2nc(C(=O)Cc3cc4nc(-c5cncc(F)c5)ccc4cn3)co2)CC1
InChIInChI=1S/C26H26FN5O2/c1-16(2)32-7-5-17(6-8-32)26-31-24(15-34-26)25(33)11-21-10-23-18(13-29-21)3-4-22(30-23)19-9-20(27)14-28-12-19/h3-4,9-10,12-17H,5-8,11H2,1-2H3
InChIKeyHWPXHMIRLBFVFD-UHFFFAOYSA-N
XLogP4.83
TPSA85.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.53
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone with MolForge

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Launch Full Analysis

Related Compounds

1-[2-[1-(2-Fluoroethyl)piperidin-4-yl]-1,3-oxazol-4-yl]-2-[2-(1-methylpyrazol-4-yl)-1,6-naphthyridin-7-yl]ethanone
CID 146940447
2-[6-(5-Fluoro-3-pyridinyl)cinnolin-3-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
CID 147078959
2-[7-(5-Fluoro-3-pyridinyl)quinazolin-2-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
CID 147291788
2-[7-(5-Fluoro-3-pyridinyl)quinazolin-2-yl]-1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
CID 147857111
1-[2-[1-(2-Fluoroethyl)piperidin-4-yl]-1,3-oxazol-4-yl]-2-[6-(1-methylpyrazol-4-yl)cinnolin-3-yl]ethanone
CID 149410419
2-[6-(5-Fluoro-3-pyridinyl)cinnolin-3-yl]-1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
CID 149582901
2-[6-(5-Fluoro-3-pyridinyl)cinnolin-3-yl]-1-(2-piperidin-4-yl-1,3-oxazol-4-yl)ethanone
CID 152947741
2-[3-(5-Fluoro-3-pyridinyl)-1,7-naphthyridin-6-yl]-1-(2-piperidin-4-yl-1,3-oxazol-4-yl)ethanone
CID 152985139
1-[2-[1-(2-Fluoroethyl)piperidin-4-yl]-1,3-oxazol-4-yl]-2-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]ethanone
CID 153130496
2-[6-(5-Fluoro-3-pyridinyl)-2,7-naphthyridin-3-yl]-1-(2-piperidin-4-yl-1,3-oxazol-4-yl)ethanone
CID 159564748
2-[6-(5-Fluoro-3-pyridinyl)isoquinolin-3-yl]-1-(2-piperidin-4-yl-1,3-oxazol-4-yl)ethanone
CID 159655174
2-[6-(5-Fluoro-3-pyridinyl)isoquinolin-3-yl]-1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone
CID 159655175

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone?
The IUPAC name of 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone (CID 158609266) is 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone.
What is the SMILES notation for 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone?
The canonical SMILES for 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone is CC(C)N1CCC(c2nc(C(=O)Cc3cc4nc(-c5cncc(F)c5)ccc4cn3)co2)CC1.
What is the InChIKey of 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone?
The InChIKey is HWPXHMIRLBFVFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26FN5O2/c1-16(2)32-7-5-17(6-8-32)26-31-24(15-34-26)25(33)11-21-10-23-18(13-29-21)3-4-22(30-23)19-9-20(27)14-28-12-19/h3-4,9-10,12-17H,5-8,11H2,1-2H3.
What are the key properties of 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone?
2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone has a molecular weight of 459.53 g/mol, XLogP of 4.83, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-fluoro-3-pyridinyl)-1,6-naphthyridin-7-yl]-1-[2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanone is sourced from PubChem (CID 158609266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).