(1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol

C20H25NO3 — CID 69291601

IUPAC(1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol
SMILESCCOc1ccccc1C[C@](O)(c1ccccc1)[C@H]1CNCCO1
InChIInChI=1S/C20H25NO3/c1-2-23-18-11-7-6-8-16(18)14-20(22,17-9-4-3-5-10-17)19-15-21-12-13-24-19/h3-11,19,21-22H,2,12-15H2,1H3/t19-,20+/m1/s1
InChIKeySJKATDZDYZMMAP-UXHICEINSA-N
MW327.42 g/mol
LogP2.50
Rot. Bonds6

About (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol

(1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol (PubChem CID 69291601) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol.

Molecular Properties

Compound Name(1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol
PubChem CID69291601
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name(1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol
SMILESCCOc1ccccc1C[C@](O)(c1ccccc1)[C@H]1CNCCO1
InChIInChI=1S/C20H25NO3/c1-2-23-18-11-7-6-8-16(18)14-20(22,17-9-4-3-5-10-17)19-15-21-12-13-24-19/h3-11,19,21-22H,2,12-15H2,1H3/t19-,20+/m1/s1
InChIKeySJKATDZDYZMMAP-UXHICEINSA-N
XLogP2.50
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[(2R)-morpholin-2-yl]-1-phenyl-2-[2-(trifluoromethoxy)phenyl]ethanol
CID 69292907
iodomethane;(1R)-1-[(2R)-morpholin-2-yl]-1-phenyl-2-[2-(trifluoromethoxy)phenyl]ethanol
CID 158449905
(1R)-2-(2-fluorophenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
CID 69289132
2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
CID 69292927
(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
CID 69290774
(1R)-2-(2,5-dimethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol
CID 159038319
2-(2,5-dimethoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
CID 69290815
2-(2,4-difluorophenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
CID 69290801
2-[2-(4-chlorophenyl)phenyl]-1-morpholin-2-yl-1-phenylethanol
CID 69290782
(1R)-2-(4,4-difluorocyclohexyl)-1-[(2S)-morpholin-2-yl]-1-phenylethanol
CID 57341754
bis(2-[(2-ethoxyphenoxy)methyl]morpholine);hydrochloride
CID 157316678
2-[(2-ethoxyphenoxy)methyl]morpholine;methane
CID 158820908

Frequently Asked Questions

What is the IUPAC name of (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol?
The IUPAC name of (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol (CID 69291601) is (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol.
What is the SMILES notation for (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol?
The canonical SMILES for (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol is CCOc1ccccc1C[C@](O)(c1ccccc1)[C@H]1CNCCO1.
What is the InChIKey of (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol?
The InChIKey is SJKATDZDYZMMAP-UXHICEINSA-N. The full InChI is InChI=1S/C20H25NO3/c1-2-23-18-11-7-6-8-16(18)14-20(22,17-9-4-3-5-10-17)19-15-21-12-13-24-19/h3-11,19,21-22H,2,12-15H2,1H3/t19-,20+/m1/s1.
What are the key properties of (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol?
(1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol has a molecular weight of 327.42 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-(2-ethoxyphenyl)-1-[(2R)-morpholin-2-yl]-1-phenylethanol is sourced from PubChem (CID 69291601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).