1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol

C15H20N2O2 — CID 56611195

IUPAC1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2=CC(c3ccccc3)ON2)CC1
InChIInChI=1S/C15H20N2O2/c18-14-6-8-17(9-7-14)11-13-10-15(19-16-13)12-4-2-1-3-5-12/h1-5,10,14-16,18H,6-9,11H2
InChIKeyFXMHONMYINRHPY-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.60
Rot. Bonds3

About 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol

1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol (PubChem CID 56611195) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol
PubChem CID56611195
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2=CC(c3ccccc3)ON2)CC1
InChIInChI=1S/C15H20N2O2/c18-14-6-8-17(9-7-14)11-13-10-15(19-16-13)12-4-2-1-3-5-12/h1-5,10,14-16,18H,6-9,11H2
InChIKeyFXMHONMYINRHPY-UHFFFAOYSA-N
XLogP1.60
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1R,2R)-2-amino-3-morpholin-4-yl-1-phenylpropan-1-ol
CID 10799824
beta-Amino-alpha-phenyl-4-morpholinepropanol
CID 11971935
3-[(4-Benzylpiperidin-1-yl)methyl]-5-(4-fluorophenyl)-2,5-dihydro-1,2-oxazole
CID 56636998
2-Amino-1-(4-fluorophenyl)-3-pyrrolidin-1-ylbut-3-en-1-ol
CID 68023186
3-(1-Oxidopiperidin-1-ium-1-yl)-1-phenylpropan-1-ol
CID 134967937
1-(4-Fluorophenyl)-3-piperazin-1-ylpropan-1-ol
CID 82073403
1-(2,5-Difluorophenyl)-3-piperazin-1-ylpropan-1-ol
CID 82074387
1-(3,4-Difluorophenyl)-3-piperazin-1-ylpropan-1-ol
CID 82074417
1-(2,4-Difluorophenyl)-3-piperazin-1-ylpropan-1-ol
CID 82299554
1-(3a-Methyl-2-phenyl-4,5,6,7-tetrahydro-[1,2]oxazolo[2,3-a]pyridin-3-yl)but-3-en-1-ol
CID 21669660
(1S,2S)-2-amino-3-morpholino-1-phenyl-1-propanol
CID 10513992
(1S)-2-[(2S)-1-methyl-1-oxido-3,6-dihydro-2H-pyridin-1-ium-2-yl]-1-phenylethanol
CID 10657295

Frequently Asked Questions

What is the IUPAC name of 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol (CID 56611195) is 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol is OC1CCN(CC2=CC(c3ccccc3)ON2)CC1.
What is the InChIKey of 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
The InChIKey is FXMHONMYINRHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-14-6-8-17(9-7-14)11-13-10-15(19-16-13)12-4-2-1-3-5-12/h1-5,10,14-16,18H,6-9,11H2.
What are the key properties of 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol has a molecular weight of 260.34 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-phenyl-2,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 56611195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).