2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol

C17H27NO2 — CID 116685478

IUPAC2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
SMILESCC(C)Cc1ccc(C(O)CC2COCC(C)N2)cc1
InChIInChI=1S/C17H27NO2/c1-12(2)8-14-4-6-15(7-5-14)17(19)9-16-11-20-10-13(3)18-16/h4-7,12-13,16-19H,8-11H2,1-3H3
InChIKeyUTOJZGLZDYASCX-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.69
Rot. Bonds5

About 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol

2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol (PubChem CID 116685478) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol.

Molecular Properties

Compound Name2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
PubChem CID116685478
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
SMILESCC(C)Cc1ccc(C(O)CC2COCC(C)N2)cc1
InChIInChI=1S/C17H27NO2/c1-12(2)8-14-4-6-15(7-5-14)17(19)9-16-11-20-10-13(3)18-16/h4-7,12-13,16-19H,8-11H2,1-3H3
InChIKeyUTOJZGLZDYASCX-UHFFFAOYSA-N
XLogP2.69
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-methylpiperidin-2-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 116685555
1-(4-ethoxyphenyl)-2-(5-methylmorpholin-3-yl)ethanol
CID 116685480
2-(5-methylmorpholin-3-yl)-1-naphthalen-2-ylethanol
CID 116685528
1-(3-bromophenyl)-2-(5-methylmorpholin-3-yl)ethanol
CID 116685463
3-[1-hydroxy-2-(5-methylmorpholin-3-yl)ethyl]benzonitrile
CID 116685719
1-[4-(2-methylpropyl)phenyl]-2-morpholin-3-ylethanamine
CID 116941475
2-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 102894005
cyclobutyl-[4-(2-methylpropyl)phenyl]methanol
CID 61099131
3-[2-(4-ethylphenyl)ethyl]-5-methylmorpholine
CID 116685903
[4-(2-methylpropyl)phenyl]-piperidin-4-ylmethanol
CID 43146481
1-[4-(2-methylpropyl)phenyl]-2-(oxan-4-ylmethoxy)ethanol
CID 62383936
(3S,4R)-4-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]oxolan-3-ol
CID 126803990

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol?
The IUPAC name of 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol (CID 116685478) is 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol.
What is the SMILES notation for 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol?
The canonical SMILES for 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol is CC(C)Cc1ccc(C(O)CC2COCC(C)N2)cc1.
What is the InChIKey of 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol?
The InChIKey is UTOJZGLZDYASCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-12(2)8-14-4-6-15(7-5-14)17(19)9-16-11-20-10-13(3)18-16/h4-7,12-13,16-19H,8-11H2,1-3H3.
What are the key properties of 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol?
2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol has a molecular weight of 277.41 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylmorpholin-3-yl)-1-[4-(2-methylpropyl)phenyl]ethanol is sourced from PubChem (CID 116685478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).