6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one

C20H24FN3O4S — CID 154571931

IUPAC6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one
SMILESO=C1COC(COc2ccc(F)cc2)CN1C1CCN(c2nc(CO)cs2)CC1
InChIInChI=1S/C20H24FN3O4S/c21-14-1-3-17(4-2-14)27-11-18-9-24(19(26)12-28-18)16-5-7-23(8-6-16)20-22-15(10-25)13-29-20/h1-4,13,16,18,25H,5-12H2
InChIKeyISQZKGWTCJBLSB-UHFFFAOYSA-N
MW421.49 g/mol
LogP2.05
Rot. Bonds6

About 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one

6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one (PubChem CID 154571931) has the molecular formula C20H24FN3O4S and a molecular weight of 421.49 g/mol. Its IUPAC name is 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one.

Molecular Properties

Compound Name6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one
PubChem CID154571931
Molecular FormulaC20H24FN3O4S
Molecular Weight421.49 g/mol
Exact Mass421.15
IUPAC Name6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one
SMILESO=C1COC(COc2ccc(F)cc2)CN1C1CCN(c2nc(CO)cs2)CC1
InChIInChI=1S/C20H24FN3O4S/c21-14-1-3-17(4-2-14)27-11-18-9-24(19(26)12-28-18)16-5-7-23(8-6-16)20-22-15(10-25)13-29-20/h1-4,13,16,18,25H,5-12H2
InChIKeyISQZKGWTCJBLSB-UHFFFAOYSA-N
XLogP2.05
TPSA75.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.49
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(4-fluorophenoxy)methyl]-4-[1-(3-fluoro-2-pyridinyl)piperidin-4-yl]morpholin-3-one
CID 154571138
(6R)-4-(1-ethylpiperidin-4-yl)-6-[(4-fluorophenoxy)methyl]morpholin-3-one
CID 125161379
4-[1-(6-amino-2-methylpyrimidin-4-yl)piperidin-4-yl]-6-[(4-fluorophenoxy)methyl]morpholin-3-one
CID 154566236
4-[1-(3-aminopropanoyl)piperidin-4-yl]-6-[(4-fluorophenoxy)methyl]morpholin-3-one;hydrochloride
CID 154919485
(6R)-6-[(4-fluorophenoxy)methyl]-4-[1-[2-(1,2,4-triazol-4-yl)ethyl]piperidin-4-yl]morpholin-3-one
CID 125159849
(6S)-4-[1-(cyclobutylmethyl)piperidin-4-yl]-6-[(4-fluorophenoxy)methyl]morpholin-3-one
CID 125178160
6-[(4-fluorophenoxy)methyl]-4-[1-[(2-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]morpholin-3-one
CID 118790903
(6S)-6-[(4-fluorophenoxy)methyl]-4-[1-[(2-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]morpholin-3-one
CID 125179516
2-[4-[(2R)-2-[(4-fluorophenoxy)methyl]-5-oxomorpholin-4-yl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 125177176
4-[1-[(1,2-dimethylimidazol-4-yl)methyl]piperidin-4-yl]-6-[(4-fluorophenoxy)methyl]morpholin-3-one
CID 146044661
6-[(4-fluorophenoxy)methyl]-4-[1-(1H-pyrazol-5-ylmethyl)piperidin-4-yl]morpholin-3-one
CID 118791221
6-[(4-fluorophenoxy)methyl]-4-[1-(pyrimidin-5-ylmethyl)piperidin-4-yl]morpholin-3-one
CID 118773433

Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one?
The IUPAC name of 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one (CID 154571931) is 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one.
What is the SMILES notation for 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one?
The canonical SMILES for 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one is O=C1COC(COc2ccc(F)cc2)CN1C1CCN(c2nc(CO)cs2)CC1.
What is the InChIKey of 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one?
The InChIKey is ISQZKGWTCJBLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN3O4S/c21-14-1-3-17(4-2-14)27-11-18-9-24(19(26)12-28-18)16-5-7-23(8-6-16)20-22-15(10-25)13-29-20/h1-4,13,16,18,25H,5-12H2.
What are the key properties of 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one?
6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one has a molecular weight of 421.49 g/mol, XLogP of 2.05, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluorophenoxy)methyl]-4-[1-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]morpholin-3-one is sourced from PubChem (CID 154571931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).