N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide

C22H23FN2O4 — CID 55553899

IUPACN-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
SMILESCC(=O)N1CCC(NC(=O)COc2ccc(C(=O)c3ccc(F)cc3)cc2)CC1
InChIInChI=1S/C22H23FN2O4/c1-15(26)25-12-10-19(11-13-25)24-21(27)14-29-20-8-4-17(5-9-20)22(28)16-2-6-18(23)7-3-16/h2-9,19H,10-14H2,1H3,(H,24,27)
InChIKeyXAOMBOWVFZLVBN-UHFFFAOYSA-N
MW398.43 g/mol
LogP2.56
Rot. Bonds6

About N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide

N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide (PubChem CID 55553899) has the molecular formula C22H23FN2O4 and a molecular weight of 398.43 g/mol. Its IUPAC name is N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
PubChem CID55553899
Molecular FormulaC22H23FN2O4
Molecular Weight398.43 g/mol
Exact Mass398.16
IUPAC NameN-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
SMILESCC(=O)N1CCC(NC(=O)COc2ccc(C(=O)c3ccc(F)cc3)cc2)CC1
InChIInChI=1S/C22H23FN2O4/c1-15(26)25-12-10-19(11-13-25)24-21(27)14-29-20-8-4-17(5-9-20)22(28)16-2-6-18(23)7-3-16/h2-9,19H,10-14H2,1H3,(H,24,27)
InChIKeyXAOMBOWVFZLVBN-UHFFFAOYSA-N
XLogP2.56
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.43
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-ethylsulfonylpiperidin-4-yl)-2-(4-fluorophenoxy)acetamide
CID 110823029
2-(4-chloro-3,5-dimethylphenoxy)-N-[1-(4-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108552732
2-(4-ethoxyphenoxy)-N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]acetamide
CID 108556268
N-[(3S)-1,1-dioxothiolan-3-yl]-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
CID 6601805
2-(4-acetylphenoxy)-N-[1-(4-methylbenzoyl)piperidin-4-yl]acetamide
CID 71933874
4-fluoro-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]benzamide
CID 33009719
methyl N-[1-[2-(4-fluorophenoxy)acetyl]piperidin-4-yl]carbamate
CID 110822979
N-[1-(4-methylbenzoyl)piperidin-4-yl]-2-[4-(4-methylphenoxy)phenoxy]acetamide
CID 75369326
2-(4-fluorophenoxy)-1-[4-(methylamino)piperidin-1-yl]ethanone
CID 119559642
2-(4-tert-butylphenoxy)-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 86812678
ethyl 4-[[2-[4-(4-fluorophenoxy)benzoyl]oxyacetyl]amino]piperidine-1-carboxylate
CID 24520834
2-(4-acetylphenoxy)-N-cyclohexylacetamide
CID 2621514

Frequently Asked Questions

What is the IUPAC name of N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide?
The IUPAC name of N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide (CID 55553899) is N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide.
What is the SMILES notation for N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide?
The canonical SMILES for N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide is CC(=O)N1CCC(NC(=O)COc2ccc(C(=O)c3ccc(F)cc3)cc2)CC1.
What is the InChIKey of N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide?
The InChIKey is XAOMBOWVFZLVBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN2O4/c1-15(26)25-12-10-19(11-13-25)24-21(27)14-29-20-8-4-17(5-9-20)22(28)16-2-6-18(23)7-3-16/h2-9,19H,10-14H2,1H3,(H,24,27).
What are the key properties of N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide?
N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide has a molecular weight of 398.43 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylpiperidin-4-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide is sourced from PubChem (CID 55553899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).