2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol

C16H25NO3 — CID 60969872

IUPAC2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1C(O)CN1CC(C)OCC1C
InChIInChI=1S/C16H25NO3/c1-11-5-6-16(19-4)14(7-11)15(18)9-17-8-13(3)20-10-12(17)2/h5-7,12-13,15,18H,8-10H2,1-4H3
InChIKeyXGYPXFDATSRVRF-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.15
Rot. Bonds4

About 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol

2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol (PubChem CID 60969872) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol
PubChem CID60969872
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1C(O)CN1CC(C)OCC1C
InChIInChI=1S/C16H25NO3/c1-11-5-6-16(19-4)14(7-11)15(18)9-17-8-13(3)20-10-12(17)2/h5-7,12-13,15,18H,8-10H2,1-4H3
InChIKeyXGYPXFDATSRVRF-UHFFFAOYSA-N
XLogP2.15
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-dimethylpiperidin-1-yl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60980968
(1R)-1-(2-chlorophenyl)-2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]ethanol
CID 94083766
2-(4-ethyl-3-methylpiperazin-1-yl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 63633648
2-(2,5-dimethylmorpholin-4-yl)-1-(3-fluoro-4-methoxyphenyl)ethanamine
CID 107519671
1-(2-methoxy-5-methylphenyl)-3-(4-methylpiperidin-1-yl)propan-1-ol
CID 82073865
5-[(2,5-dimethylmorpholin-4-yl)methyl]-2-methoxybenzenecarbothioamide
CID 65339637
1-(2-methoxy-5-methylphenyl)-2-(3-propylpyrrolidin-1-yl)ethanol
CID 115667609
1-(2-methoxy-5-methylphenyl)pentan-1-ol
CID 61080930
1-(2-methoxy-5-methylphenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65158286
methyl 4-hydroxy-4-(2-methoxy-5-methylphenyl)butanoate
CID 82347001
1-(2-methoxy-5-methylphenyl)decan-1-ol
CID 65427724
2-(3,5-dimethylcyclohexyl)oxy-1-(2-methoxy-5-methylphenyl)ethanol
CID 64728823

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
The IUPAC name of 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol (CID 60969872) is 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
The canonical SMILES for 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol is COc1ccc(C)cc1C(O)CN1CC(C)OCC1C.
What is the InChIKey of 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
The InChIKey is XGYPXFDATSRVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-11-5-6-16(19-4)14(7-11)15(18)9-17-8-13(3)20-10-12(17)2/h5-7,12-13,15,18H,8-10H2,1-4H3.
What are the key properties of 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol?
2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol has a molecular weight of 279.38 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylmorpholin-4-yl)-1-(2-methoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 60969872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).