1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol

C16H24FNO2 — CID 62629822

IUPAC1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol
SMILESCC1CN(CCC(O)c2ccc(F)cc2)CC(C)(C)O1
InChIInChI=1S/C16H24FNO2/c1-12-10-18(11-16(2,3)20-12)9-8-15(19)13-4-6-14(17)7-5-13/h4-7,12,15,19H,8-11H2,1-3H3
InChIKeyPECWQVNXOMYXQL-UHFFFAOYSA-N
MW281.37 g/mol
LogP2.75
Rot. Bonds4

About 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol

1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol (PubChem CID 62629822) has the molecular formula C16H24FNO2 and a molecular weight of 281.37 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol
PubChem CID62629822
Molecular FormulaC16H24FNO2
Molecular Weight281.37 g/mol
Exact Mass281.18
IUPAC Name1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol
SMILESCC1CN(CCC(O)c2ccc(F)cc2)CC(C)(C)O1
InChIInChI=1S/C16H24FNO2/c1-12-10-18(11-16(2,3)20-12)9-8-15(19)13-4-6-14(17)7-5-13/h4-7,12,15,19H,8-11H2,1-3H3
InChIKeyPECWQVNXOMYXQL-UHFFFAOYSA-N
XLogP2.75
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.37
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(2,5-difluorophenyl)-2-[(6R)-2,2,6-trimethylmorpholin-4-yl]ethanol
CID 95586158
4-[4-(2,2,6-trimethylmorpholin-4-yl)butan-2-yl]aniline
CID 104501614
3-(4,4-dimethylpiperidin-1-yl)-1-(4-fluorophenyl)propan-1-ol
CID 62932007
1-(3,4-dimethylphenyl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanol
CID 48632369
1-(4-methylphenyl)-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
CID 102745848
6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol
CID 106802367
1-(4-chlorophenyl)-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propan-1-ol
CID 104960789
1-(4-fluorophenyl)-3-(3-methylpiperidin-1-yl)propan-1-ol
CID 55099022
1-(4-fluorophenyl)-3-piperazin-1-ylpropan-1-ol
CID 82073403
3-(2,2-dimethylmorpholin-4-yl)-1-(4-methylphenyl)propan-1-ol
CID 62619165
1-(2-aminophenyl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanol
CID 62266500
3-(3,6-dihydro-2H-pyridin-1-yl)-1-(4-fluorophenyl)propan-1-ol
CID 140969182

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol?
The IUPAC name of 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol (CID 62629822) is 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol.
What is the SMILES notation for 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol?
The canonical SMILES for 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol is CC1CN(CCC(O)c2ccc(F)cc2)CC(C)(C)O1.
What is the InChIKey of 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol?
The InChIKey is PECWQVNXOMYXQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO2/c1-12-10-18(11-16(2,3)20-12)9-8-15(19)13-4-6-14(17)7-5-13/h4-7,12,15,19H,8-11H2,1-3H3.
What are the key properties of 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol?
1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol has a molecular weight of 281.37 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol is sourced from PubChem (CID 62629822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).