(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol

C14H21NO2 — CID 78939798

IUPAC(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol
SMILESCCC1COCCN1c1ccc([C@@H](C)O)cc1
InChIInChI=1S/C14H21NO2/c1-3-13-10-17-9-8-15(13)14-6-4-12(5-7-14)11(2)16/h4-7,11,13,16H,3,8-10H2,1-2H3/t11-,13?/m1/s1
InChIKeyZHTFNOSGBSPLSQ-JTDNENJMSA-N
MW235.33 g/mol
LogP2.36
Rot. Bonds3

About (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol

(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol (PubChem CID 78939798) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol
PubChem CID78939798
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol
SMILESCCC1COCCN1c1ccc([C@@H](C)O)cc1
InChIInChI=1S/C14H21NO2/c1-3-13-10-17-9-8-15(13)14-6-4-12(5-7-14)11(2)16/h4-7,11,13,16H,3,8-10H2,1-2H3/t11-,13?/m1/s1
InChIKeyZHTFNOSGBSPLSQ-JTDNENJMSA-N
XLogP2.36
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 ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-[3-chloro-4-(3-ethylmorpholin-4-yl)phenyl]ethanol
CID 55183017
(1S)-1-[4-(3-ethylmorpholin-4-yl)-3-fluorophenyl]ethanol
CID 78939791
3-ethyl-4-phenylmorpholine
CID 154695616
4-[4-(bromomethyl)phenyl]-3-ethylmorpholine
CID 107080615
4-(3-ethylmorpholin-4-yl)benzenecarbothioamide
CID 43613424
(1R)-1-[4-(3-ethylmorpholin-4-yl)-3-nitrophenyl]ethanol
CID 63370957
1-[5-(3-ethylmorpholin-4-yl)-2-pyridinyl]ethanamine
CID 83122399
2-[1-(ethylamino)ethyl]-5-(3-ethylmorpholin-4-yl)phenol
CID 79600243
(1S)-1-[2-(3-ethylmorpholin-4-yl)-6-fluorophenyl]ethanol
CID 78939877
4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline
CID 83001872
N-cyclopropyl-4-[4-(1-hydroxyethyl)phenyl]morpholine-3-carboxamide
CID 83101406
(3R)-3-methyl-4-(4-propan-2-ylphenyl)morpholine
CID 159859057

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol?
The IUPAC name of (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol (CID 78939798) is (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol.
What is the SMILES notation for (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol?
The canonical SMILES for (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol is CCC1COCCN1c1ccc([C@@H](C)O)cc1.
What is the InChIKey of (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol?
The InChIKey is ZHTFNOSGBSPLSQ-JTDNENJMSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-13-10-17-9-8-15(13)14-6-4-12(5-7-14)11(2)16/h4-7,11,13,16H,3,8-10H2,1-2H3/t11-,13?/m1/s1.
What are the key properties of (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol?
(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol has a molecular weight of 235.33 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol is sourced from PubChem (CID 78939798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).