1-phenyl-3-piperidin-4-yloxypropan-1-one

C14H19NO2 — CID 116572261

IUPAC1-phenyl-3-piperidin-4-yloxypropan-1-one
SMILESO=C(CCOC1CCNCC1)c1ccccc1
InChIInChI=1S/C14H19NO2/c16-14(12-4-2-1-3-5-12)8-11-17-13-6-9-15-10-7-13/h1-5,13,15H,6-11H2
InChIKeyNASWJTGAUBDRJB-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.03
Rot. Bonds5

About 1-phenyl-3-piperidin-4-yloxypropan-1-one

1-phenyl-3-piperidin-4-yloxypropan-1-one (PubChem CID 116572261) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-phenyl-3-piperidin-4-yloxypropan-1-one.

Molecular Properties

Compound Name1-phenyl-3-piperidin-4-yloxypropan-1-one
PubChem CID116572261
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-phenyl-3-piperidin-4-yloxypropan-1-one
SMILESO=C(CCOC1CCNCC1)c1ccccc1
InChIInChI=1S/C14H19NO2/c16-14(12-4-2-1-3-5-12)8-11-17-13-6-9-15-10-7-13/h1-5,13,15H,6-11H2
InChIKeyNASWJTGAUBDRJB-UHFFFAOYSA-N
XLogP2.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-3-piperidin-4-yloxypropanamide
CID 63877329
1-(3,4-dimethoxyphenyl)-3-piperidin-4-yloxypropan-1-one
CID 116572273
3-(3-methoxycyclopentyl)oxy-1-phenylpropan-1-one
CID 54482075
N-methyl-N-(1-phenylethyl)-3-piperidin-4-yloxypropanamide
CID 63876681
1-(2,4-dichlorophenyl)-3-piperidin-4-yloxypropan-1-one
CID 114281145
3-(azepan-4-yl)-1-phenylpropan-1-one
CID 142133654
N-(2-chlorophenyl)-3-piperidin-4-yloxypropanamide
CID 63877513
3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one
CID 82691756
N-(2-fluorophenyl)-N-methyl-3-piperidin-4-yloxypropanamide
CID 63905455
1-(4-bromo-3-chloro-2-fluorophenyl)-3-piperidin-4-yloxypropan-1-one
CID 106763987
4-(oxetan-3-yloxy)-1-phenylbutan-1-one
CID 102607070
3-piperidin-4-yloxy-N-(2-propan-2-ylphenyl)propanamide
CID 63877511

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-piperidin-4-yloxypropan-1-one?
The IUPAC name of 1-phenyl-3-piperidin-4-yloxypropan-1-one (CID 116572261) is 1-phenyl-3-piperidin-4-yloxypropan-1-one.
What is the SMILES notation for 1-phenyl-3-piperidin-4-yloxypropan-1-one?
The canonical SMILES for 1-phenyl-3-piperidin-4-yloxypropan-1-one is O=C(CCOC1CCNCC1)c1ccccc1.
What is the InChIKey of 1-phenyl-3-piperidin-4-yloxypropan-1-one?
The InChIKey is NASWJTGAUBDRJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c16-14(12-4-2-1-3-5-12)8-11-17-13-6-9-15-10-7-13/h1-5,13,15H,6-11H2.
What are the key properties of 1-phenyl-3-piperidin-4-yloxypropan-1-one?
1-phenyl-3-piperidin-4-yloxypropan-1-one has a molecular weight of 233.31 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-piperidin-4-yloxypropan-1-one is sourced from PubChem (CID 116572261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).