3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol

C15H22FNO2 — CID 62629462

IUPAC3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol
SMILESCC1CN(CCC(O)c2cccc(F)c2)C(C)CO1
InChIInChI=1S/C15H22FNO2/c1-11-10-19-12(2)9-17(11)7-6-15(18)13-4-3-5-14(16)8-13/h3-5,8,11-12,15,18H,6-7,9-10H2,1-2H3
InChIKeyPZAYBKJQJSHQPZ-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.36
Rot. Bonds4

About 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol

3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol (PubChem CID 62629462) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol.

Molecular Properties

Compound Name3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol
PubChem CID62629462
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol
SMILESCC1CN(CCC(O)c2cccc(F)c2)C(C)CO1
InChIInChI=1S/C15H22FNO2/c1-11-10-19-12(2)9-17(11)7-6-15(18)13-4-3-5-14(16)8-13/h3-5,8,11-12,15,18H,6-7,9-10H2,1-2H3
InChIKeyPZAYBKJQJSHQPZ-UHFFFAOYSA-N
XLogP2.36
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-bromophenyl)-3-(2,5-dimethylmorpholin-4-yl)propan-1-ol
CID 55099046
1-(3-fluorophenyl)-3-(2-methylpyrrolidin-1-yl)propan-1-ol
CID 62645250
N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-3-fluoroaniline
CID 62559855
1-(3-fluoro-4-methylphenyl)-3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-1-ol
CID 81212826
(1S)-2-[(2R)-2,4-dimethylpiperazin-1-yl]-1-(3-fluorophenyl)ethanol
CID 100846119
3-(4,4-dimethylpiperidin-1-yl)-1-(3-fluorophenyl)propan-1-ol
CID 55156133
3-(4-tert-butylpiperidin-1-yl)-1-(3-fluorophenyl)propan-1-ol
CID 62630321
1-(3-bromophenyl)-3-(3-methylmorpholin-4-yl)propan-1-ol
CID 55099044
(1R)-3-(1,3-dioxan-2-yl)-1-(3-fluorophenyl)propan-1-ol
CID 97293344
3-(1,3-dioxan-2-yl)-1-(3-fluorophenyl)propan-1-ol
CID 91658309
1-(3-fluorophenyl)-3-[2-(2-hydroxyethyl)piperidin-1-yl]propan-1-ol
CID 62645441
N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-4-fluoroaniline
CID 62561905

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol?
The IUPAC name of 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol (CID 62629462) is 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol.
What is the SMILES notation for 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol?
The canonical SMILES for 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol is CC1CN(CCC(O)c2cccc(F)c2)C(C)CO1.
What is the InChIKey of 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol?
The InChIKey is PZAYBKJQJSHQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-11-10-19-12(2)9-17(11)7-6-15(18)13-4-3-5-14(16)8-13/h3-5,8,11-12,15,18H,6-7,9-10H2,1-2H3.
What are the key properties of 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol?
3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol has a molecular weight of 267.34 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethylmorpholin-4-yl)-1-(3-fluorophenyl)propan-1-ol is sourced from PubChem (CID 62629462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).