(2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol

C19H23NO3 — CID 92858701

IUPAC(2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol
SMILESCCN1CCO[C@@](O)(c2ccc(OC)cc2)[C@@H]1c1ccccc1
InChIInChI=1S/C19H23NO3/c1-3-20-13-14-23-19(21,16-9-11-17(22-2)12-10-16)18(20)15-7-5-4-6-8-15/h4-12,18,21H,3,13-14H2,1-2H3/t18-,19-/m0/s1
InChIKeyXTLHGYHVKNWIIV-OALUTQOASA-N
MW313.40 g/mol
LogP2.93
Rot. Bonds4

About (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol

(2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol (PubChem CID 92858701) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol.

Molecular Properties

Compound Name(2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol
PubChem CID92858701
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name(2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol
SMILESCCN1CCO[C@@](O)(c2ccc(OC)cc2)[C@@H]1c1ccccc1
InChIInChI=1S/C19H23NO3/c1-3-20-13-14-23-19(21,16-9-11-17(22-2)12-10-16)18(20)15-7-5-4-6-8-15/h4-12,18,21H,3,13-14H2,1-2H3/t18-,19-/m0/s1
InChIKeyXTLHGYHVKNWIIV-OALUTQOASA-N
XLogP2.93
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3S)-4-ethyl-3-(4-methoxyphenyl)-2-phenylmorpholin-2-ol
CID 92859022
4-ethyl-3-(4-methoxyphenyl)-2-phenylmorpholin-3-ol
CID 139270337
4-(2-hydroxyethyl)-3-methyl-2-(4-phenylmethoxyphenyl)morpholin-2-ol
CID 141298274
(2S,3R)-1,4-diethyl-2,3-bis(4-methoxyphenyl)piperazine
CID 11013665
[(3S,4R)-3-(4-methoxyphenyl)-4-phenyl-2-(2-phenylpropan-2-yl)oxazetidin-4-yl]methanol
CID 101407263
[2-(4-methoxyphenyl)oxetan-2-yl]methanol
CID 117258820
2-(4-methoxyphenyl)-1,3-dihydroinden-2-ol
CID 15112860
(1R,5S)-8-benzyl-3-(4-methoxyphenyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 13091234
8-(4-methoxyphenyl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 10934332
(3R)-1-benzyl-3-(4-methoxyphenyl)piperidin-3-ol
CID 92976626
(2R)-1-ethyl-2-(4-methoxyphenyl)pyrrolidine
CID 124500800
(1S,2S,3R,4R,5S,6S)-2-[(4-methoxyphenyl)methoxy]-3,4,5,6-tetrakis(phenylmethoxy)cyclohexan-1-ol
CID 11039611

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol?
The IUPAC name of (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol (CID 92858701) is (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol.
What is the SMILES notation for (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol?
The canonical SMILES for (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol is CCN1CCO[C@@](O)(c2ccc(OC)cc2)[C@@H]1c1ccccc1.
What is the InChIKey of (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol?
The InChIKey is XTLHGYHVKNWIIV-OALUTQOASA-N. The full InChI is InChI=1S/C19H23NO3/c1-3-20-13-14-23-19(21,16-9-11-17(22-2)12-10-16)18(20)15-7-5-4-6-8-15/h4-12,18,21H,3,13-14H2,1-2H3/t18-,19-/m0/s1.
What are the key properties of (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol?
(2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol has a molecular weight of 313.40 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-4-ethyl-2-(4-methoxyphenyl)-3-phenylmorpholin-2-ol is sourced from PubChem (CID 92858701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).