piperidin-2-yl 2-phenylacetate

C13H17NO2 — CID 154340125

IUPACpiperidin-2-yl 2-phenylacetate
SMILESO=C(Cc1ccccc1)OC1CCCCN1
InChIInChI=1S/C13H17NO2/c15-13(10-11-6-2-1-3-7-11)16-12-8-4-5-9-14-12/h1-3,6-7,12,14H,4-5,8-10H2
InChIKeySRMFGLFMEYSXEG-UHFFFAOYSA-N
MW219.28 g/mol
LogP1.87
Rot. Bonds3

About piperidin-2-yl 2-phenylacetate

piperidin-2-yl 2-phenylacetate (PubChem CID 154340125) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is piperidin-2-yl 2-phenylacetate.

Molecular Properties

Compound Namepiperidin-2-yl 2-phenylacetate
PubChem CID154340125
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Namepiperidin-2-yl 2-phenylacetate
SMILESO=C(Cc1ccccc1)OC1CCCCN1
InChIInChI=1S/C13H17NO2/c15-13(10-11-6-2-1-3-7-11)16-12-8-4-5-9-14-12/h1-3,6-7,12,14H,4-5,8-10H2
InChIKeySRMFGLFMEYSXEG-UHFFFAOYSA-N
XLogP1.87
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl 2-phenylacetate
CID 135066962
2-[(2S)-piperidin-2-yl]ethyl 2-phenylacetate
CID 86319530
1-phenyl-3-piperidin-2-ylpropan-2-one
CID 22237365
cyclohexyl 2-phenylacetate;methyl 2-phenylacetate
CID 5314269
(4-oxocyclohexyl) 2-phenylacetate
CID 175483439
[(2S,3S)-3-(2-phenylacetyl)oxy-1,4-dioxan-2-yl] 2-phenylacetate
CID 1106174
N-benzylpiperidine-2-carboxamide;hydrochloride
CID 53410820
3-oxo-3-piperidin-2-ylpropanenitrile;2-phenylacetic acid
CID 89483012
(phenylmethoxyamino) (2S)-piperidine-2-carboxylate
CID 139413453
N-benzyl-N-cyclopropylpiperidine-2-carboxamide
CID 43579225
benzyl 3-[(2S)-pyrrolidin-2-yl]propanoate
CID 58375773
2-phenoxyethyl (2R)-piperidine-2-carboxylate
CID 79034822

Frequently Asked Questions

What is the IUPAC name of piperidin-2-yl 2-phenylacetate?
The IUPAC name of piperidin-2-yl 2-phenylacetate (CID 154340125) is piperidin-2-yl 2-phenylacetate.
What is the SMILES notation for piperidin-2-yl 2-phenylacetate?
The canonical SMILES for piperidin-2-yl 2-phenylacetate is O=C(Cc1ccccc1)OC1CCCCN1.
What is the InChIKey of piperidin-2-yl 2-phenylacetate?
The InChIKey is SRMFGLFMEYSXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c15-13(10-11-6-2-1-3-7-11)16-12-8-4-5-9-14-12/h1-3,6-7,12,14H,4-5,8-10H2.
What are the key properties of piperidin-2-yl 2-phenylacetate?
piperidin-2-yl 2-phenylacetate has a molecular weight of 219.28 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-2-yl 2-phenylacetate is sourced from PubChem (CID 154340125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).