2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone

C19H21FN2O3 — CID 71799565

IUPAC2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
SMILESCc1cccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1
InChIInChI=1S/C19H21FN2O3/c1-14-5-4-8-18(21-14)25-15-9-11-22(12-10-15)19(23)13-24-17-7-3-2-6-16(17)20/h2-8,15H,9-13H2,1H3
InChIKeyUOVIFXOSWQZOOS-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.98
Rot. Bonds5

About 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone

2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone (PubChem CID 71799565) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
PubChem CID71799565
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Name2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
SMILESCc1cccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1
InChIInChI=1S/C19H21FN2O3/c1-14-5-4-8-18(21-14)25-15-9-11-22(12-10-15)19(23)13-24-17-7-3-2-6-16(17)20/h2-8,15H,9-13H2,1H3
InChIKeyUOVIFXOSWQZOOS-UHFFFAOYSA-N
XLogP2.98
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(1-Methylpyrrol-2-yl)methyl]piperazin-1-yl]-2-phenoxyethanone
CID 828791
N-ethyl-N-(3-methylphenyl)-2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]acetamide
CID 168271423
N-ethyl-N-(3-methylphenyl)-2-[(6-methyl-4-propan-2-yl-2-pyridinyl)oxy]acetamide
CID 168281454
2-[(3-cyano-4,6-dimethyl-2-pyridinyl)oxy]-N-ethyl-N-phenylacetamide
CID 17088130
1-{6-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl]-pyridin-2-ylmethyl}-piperidin-2-one; hydrochloride
CID 10740929
US11072585, Example 41
CID 122536431
2-(2-Methoxyphenoxy)-1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}propan-1-one
CID 16015784
4-[(2-fluorophenyl)methyl]-7-phenylmethoxy-5H-pyrido[2,3-f][1,4]oxazepin-3-one
CID 134805893
7-[(4-fluorophenyl)methoxy]-4-(2-phenoxyethyl)-5H-pyrido[2,3-f][1,4]oxazepin-3-one
CID 134808621
7-[(4-fluorophenyl)methoxy]-4-[(3-methoxyphenyl)methyl]-5H-pyrido[2,3-f][1,4]oxazepin-3-one
CID 134808952
2-[(4,6-dimethyl-2-pyridinyl)oxy]-N-ethyl-N-(3-methylphenyl)acetamide
CID 168293683
N,N-diethyl-2-[(2-ethyl-6-methylpyridin-3-yl)oxy]acetamide
CID 567948

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The IUPAC name of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone (CID 71799565) is 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone.
What is the SMILES notation for 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The canonical SMILES for 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone is Cc1cccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1.
What is the InChIKey of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The InChIKey is UOVIFXOSWQZOOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-14-5-4-8-18(21-14)25-15-9-11-22(12-10-15)19(23)13-24-17-7-3-2-6-16(17)20/h2-8,15H,9-13H2,1H3.
What are the key properties of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone has a molecular weight of 344.39 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone is sourced from PubChem (CID 71799565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).