2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone

C21H19FN2O3 — CID 172667855

IUPAC2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone
SMILESO=C(COc1ccc2ccc(-c3cncc(F)c3)cc2c1)N1CCOCC1
InChIInChI=1S/C21H19FN2O3/c22-19-10-18(12-23-13-19)16-2-1-15-3-4-20(11-17(15)9-16)27-14-21(25)24-5-7-26-8-6-24/h1-4,9-13H,5-8,14H2
InChIKeyFAOVVUWIPVIUAH-UHFFFAOYSA-N
MW366.39 g/mol
LogP3.28
Rot. Bonds4

About 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone

2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone (PubChem CID 172667855) has the molecular formula C21H19FN2O3 and a molecular weight of 366.39 g/mol. Its IUPAC name is 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone
PubChem CID172667855
Molecular FormulaC21H19FN2O3
Molecular Weight366.39 g/mol
Exact Mass366.14
IUPAC Name2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone
SMILESO=C(COc1ccc2ccc(-c3cncc(F)c3)cc2c1)N1CCOCC1
InChIInChI=1S/C21H19FN2O3/c22-19-10-18(12-23-13-19)16-2-1-15-3-4-20(11-17(15)9-16)27-14-21(25)24-5-7-26-8-6-24/h1-4,9-13H,5-8,14H2
InChIKeyFAOVVUWIPVIUAH-UHFFFAOYSA-N
XLogP3.28
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.39
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[7-(4-hydroxy-3-methoxyphenyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone
CID 172661465
2-[6-(4-methoxy-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone
CID 172662683
2-(4-methylphenoxy)-1-morpholin-4-ylethanone
CID 674914
3-acetyloxy-7-(2-morpholin-4-yl-2-oxoethoxy)naphthalene-2-carboxylic acid
CID 70031847
2-[3-[5-(3-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]-1-morpholin-4-ylethanone
CID 45032454
1,1,1,3,3,3-hexafluoropropan-2-yl 5-(2-morpholin-4-yl-2-oxoethoxy)isoindole-2-carboxylate
CID 138619134
2-fluoro-4-(2-morpholin-4-yl-2-oxoethoxy)benzonitrile
CID 78952730
2-[3-fluoro-4-[(1R)-1-hydroxyethyl]phenoxy]-1-morpholin-4-ylethanone
CID 107720138
2-(4-hydroxyphenoxy)-1-morpholin-4-ylethanone
CID 43143408
2-[3-(1-methylpyrazol-4-yl)phenoxy]-1-morpholin-4-ylethanone
CID 91027875
2-(2,4-difluorophenoxy)-1-morpholin-4-ylethanone
CID 17190869
2-[4-(furan-2-yl)phenoxy]-1-morpholin-4-ylethanone
CID 168524915

Frequently Asked Questions

What is the IUPAC name of 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone?
The IUPAC name of 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone (CID 172667855) is 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone is O=C(COc1ccc2ccc(-c3cncc(F)c3)cc2c1)N1CCOCC1.
What is the InChIKey of 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone?
The InChIKey is FAOVVUWIPVIUAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O3/c22-19-10-18(12-23-13-19)16-2-1-15-3-4-20(11-17(15)9-16)27-14-21(25)24-5-7-26-8-6-24/h1-4,9-13H,5-8,14H2.
What are the key properties of 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone?
2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone has a molecular weight of 366.39 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-(5-fluoro-3-pyridinyl)naphthalen-2-yl]oxy-1-morpholin-4-ylethanone is sourced from PubChem (CID 172667855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).