5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one

C19H24N2O3 — CID 72883625

IUPAC5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one
SMILESO=c1ccc(-c2ccccc2OCC(O)CN2CCCCC2)c[nH]1
InChIInChI=1S/C19H24N2O3/c22-16(13-21-10-4-1-5-11-21)14-24-18-7-3-2-6-17(18)15-8-9-19(23)20-12-15/h2-3,6-9,12,16,22H,1,4-5,10-11,13-14H2,(H,20,23)
InChIKeyXCGIWMGDOIZHLW-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.27
Rot. Bonds6

About 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one

5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one (PubChem CID 72883625) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one
PubChem CID72883625
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one
SMILESO=c1ccc(-c2ccccc2OCC(O)CN2CCCCC2)c[nH]1
InChIInChI=1S/C19H24N2O3/c22-16(13-21-10-4-1-5-11-21)14-24-18-7-3-2-6-17(18)15-8-9-19(23)20-12-15/h2-3,6-9,12,16,22H,1,4-5,10-11,13-14H2,(H,20,23)
InChIKeyXCGIWMGDOIZHLW-UHFFFAOYSA-N
XLogP2.27
TPSA65.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-piperidin-1-yl-3-(2-pyridin-4-ylphenoxy)propan-2-ol
CID 45200033
(2R)-1-(azepan-1-yl)-3-(2-chlorophenoxy)propan-2-ol
CID 2141702
1-(azepan-1-yl)-3-(2-chlorophenoxy)propan-2-ol
CID 16807396
(2R)-1-(2-bromophenoxy)-3-piperidin-1-ylpropan-2-ol
CID 808358
(2R)-1-(2-methylphenoxy)-3-piperidin-1-ylpropan-2-ol
CID 1149958
1-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]ethanone
CID 2968485
1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-(2-phenylphenoxy)propan-2-ol
CID 43842332
1-(2-aminophenoxy)-3-pyrrolidin-1-ylpropan-2-ol
CID 43364467
1-naphthalen-1-yloxy-3-piperidin-1-ylpropan-2-ol;hydrochloride
CID 14556459
1-(2-bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol;hydrochloride
CID 2914509
2-(2-hydroxy-3-piperidin-1-ylpropoxy)benzonitrile
CID 43288772
1-(2-propan-2-ylphenoxy)-3-pyrrolidin-1-ylpropan-2-ol
CID 3488317

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one?
The IUPAC name of 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one (CID 72883625) is 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one is O=c1ccc(-c2ccccc2OCC(O)CN2CCCCC2)c[nH]1.
What is the InChIKey of 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one?
The InChIKey is XCGIWMGDOIZHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c22-16(13-21-10-4-1-5-11-21)14-24-18-7-3-2-6-17(18)15-8-9-19(23)20-12-15/h2-3,6-9,12,16,22H,1,4-5,10-11,13-14H2,(H,20,23).
What are the key properties of 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one?
5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one has a molecular weight of 328.41 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]-1H-pyridin-2-one is sourced from PubChem (CID 72883625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).