2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol

C14H21NO2 — CID 82976721

IUPAC2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol
SMILESCCC1CN(C(C)c2ccccc2O)CCO1
InChIInChI=1S/C14H21NO2/c1-3-12-10-15(8-9-17-12)11(2)13-6-4-5-7-14(13)16/h4-7,11-12,16H,3,8-10H2,1-2H3
InChIKeyVYSHGJZVZNEYAM-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.56
Rot. Bonds3

About 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol

2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol (PubChem CID 82976721) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol.

Molecular Properties

Compound Name2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol
PubChem CID82976721
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol
SMILESCCC1CN(C(C)c2ccccc2O)CCO1
InChIInChI=1S/C14H21NO2/c1-3-12-10-15(8-9-17-12)11(2)13-6-4-5-7-14(13)16/h4-7,11-12,16H,3,8-10H2,1-2H3
InChIKeyVYSHGJZVZNEYAM-UHFFFAOYSA-N
XLogP2.56
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

2-[1-(2-ethylmorpholin-4-yl)ethyl]-5-methylphenol
CID 82976718
1-(2-ethylmorpholin-4-yl)-1-(2-fluorophenyl)propan-2-amine
CID 55018636
5-[1-(2-ethylmorpholin-4-yl)ethyl]furan-2-carboxylic acid
CID 79083918
2-(2-ethylmorpholin-4-yl)-1-phenylpropan-1-amine
CID 43562634
2-(2-bromophenyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562548
2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol
CID 115314981
[4-[1-(2,3-dichlorophenyl)ethyl]morpholin-2-yl]methanamine
CID 114079708
N-[1-[2-(2-ethylmorpholin-4-yl)phenyl]ethyl]propan-1-amine
CID 43562783
4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine
CID 64763487
(1R)-1-(2-methylphenyl)-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
CID 81374031
2-(2-ethylmorpholin-4-yl)-N-methyl-2-phenylethanamine
CID 62433539
[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol
CID 99108798

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol?
The IUPAC name of 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol (CID 82976721) is 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol.
What is the SMILES notation for 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol?
The canonical SMILES for 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol is CCC1CN(C(C)c2ccccc2O)CCO1.
What is the InChIKey of 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol?
The InChIKey is VYSHGJZVZNEYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-12-10-15(8-9-17-12)11(2)13-6-4-5-7-14(13)16/h4-7,11-12,16H,3,8-10H2,1-2H3.
What are the key properties of 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol?
2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol has a molecular weight of 235.33 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol is sourced from PubChem (CID 82976721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).