2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol

C14H20ClNO2 — CID 79666850

IUPAC2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
SMILESCCN1CCOC(C(O)Cc2cccc(Cl)c2)C1
InChIInChI=1S/C14H20ClNO2/c1-2-16-6-7-18-14(10-16)13(17)9-11-4-3-5-12(15)8-11/h3-5,8,13-14,17H,2,6-7,9-10H2,1H3
InChIKeyINKQAUVPZWRWIS-UHFFFAOYSA-N
MW269.77 g/mol
LogP1.96
Rot. Bonds4

About 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol

2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol (PubChem CID 79666850) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
PubChem CID79666850
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
SMILESCCN1CCOC(C(O)Cc2cccc(Cl)c2)C1
InChIInChI=1S/C14H20ClNO2/c1-2-16-6-7-18-14(10-16)13(17)9-11-4-3-5-12(15)8-11/h3-5,8,13-14,17H,2,6-7,9-10H2,1H3
InChIKeyINKQAUVPZWRWIS-UHFFFAOYSA-N
XLogP1.96
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79666362
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666603
2-(3,4-difluorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 82919753
(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol
CID 116543719
2-(3-chlorophenyl)-1-(1,4-dioxan-2-yl)ethanol
CID 65350697
1-(4-ethylmorpholin-2-yl)-2-(3-fluorophenyl)ethanamine
CID 79666865
(1S)-1-[(2R)-4-ethylmorpholin-2-yl]ethane-1,2-diol
CID 177187353
2-(3-fluorophenyl)-1-(4-methylmorpholin-2-yl)ethanol
CID 79087183
1-(4-ethylmorpholin-2-yl)-2-(5-ethyl-2-pyridinyl)ethanol
CID 79745916
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79666279
2-(2,5-dimethylpyrazol-3-yl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666506
2-(3-chloro-4-fluorophenyl)-1-(4-ethylmorpholin-2-yl)-N-methylethanamine
CID 103040274

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol?
The IUPAC name of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol (CID 79666850) is 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol?
The canonical SMILES for 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol is CCN1CCOC(C(O)Cc2cccc(Cl)c2)C1.
What is the InChIKey of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol?
The InChIKey is INKQAUVPZWRWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-2-16-6-7-18-14(10-16)13(17)9-11-4-3-5-12(15)8-11/h3-5,8,13-14,17H,2,6-7,9-10H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol?
2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol has a molecular weight of 269.77 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol is sourced from PubChem (CID 79666850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).