N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide

C16H20F2N2O2 — CID 113133399

IUPACN-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
SMILESCC(=O)N(CCC(=O)N1CCCCC1)c1ccc(F)cc1F
InChIInChI=1S/C16H20F2N2O2/c1-12(21)20(15-6-5-13(17)11-14(15)18)10-7-16(22)19-8-3-2-4-9-19/h5-6,11H,2-4,7-10H2,1H3
InChIKeyDHUZWGALNQMLFB-UHFFFAOYSA-N
MW310.34 g/mol
LogP2.72
Rot. Bonds4

About N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide

N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide (PubChem CID 113133399) has the molecular formula C16H20F2N2O2 and a molecular weight of 310.34 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
PubChem CID113133399
Molecular FormulaC16H20F2N2O2
Molecular Weight310.34 g/mol
Exact Mass310.15
IUPAC NameN-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
SMILESCC(=O)N(CCC(=O)N1CCCCC1)c1ccc(F)cc1F
InChIInChI=1S/C16H20F2N2O2/c1-12(21)20(15-6-5-13(17)11-14(15)18)10-7-16(22)19-8-3-2-4-9-19/h5-6,11H,2-4,7-10H2,1H3
InChIKeyDHUZWGALNQMLFB-UHFFFAOYSA-N
XLogP2.72
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.34
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
CID 113132342
3-(N-acetyl-2,4-difluoroanilino)propanoic acid
CID 28764816
N-[3-(azepan-1-yl)-3-oxopropyl]-N-(2,6-difluorophenyl)acetamide
CID 113135398
3-(N-acetyl-2,4-difluoroanilino)-N-cyclopentylpropanamide
CID 113133398
methyl 2-[acetyl-(3-oxo-3-piperidin-1-ylpropyl)amino]benzoate
CID 113131207
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-N-phenylacetamide
CID 113123338
N-(2-ethoxyphenyl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)acetamide
CID 113129221
N-(2-fluorophenyl)-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]acetamide
CID 113126709
N-(4-acetylphenyl)-N-[3-(azepan-1-yl)-3-oxopropyl]acetamide
CID 113130850
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(2-fluorophenyl)acetamide
CID 113170791
N-(2-cyanophenyl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)acetamide
CID 113134658
N-[3-(azepan-1-yl)-3-oxopropyl]-N-(4-chloro-2,5-dimethoxyphenyl)acetamide
CID 113134403

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide?
The IUPAC name of N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide (CID 113133399) is N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide is CC(=O)N(CCC(=O)N1CCCCC1)c1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide?
The InChIKey is DHUZWGALNQMLFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20F2N2O2/c1-12(21)20(15-6-5-13(17)11-14(15)18)10-7-16(22)19-8-3-2-4-9-19/h5-6,11H,2-4,7-10H2,1H3.
What are the key properties of N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide?
N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide has a molecular weight of 310.34 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide is sourced from PubChem (CID 113133399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).