(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid

C18H19NO4 — CID 68617082

IUPAC(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid
SMILESO=C(O)N1CCO[C@H](c2ccc(OCc3ccccc3)cc2)C1
InChIInChI=1S/C18H19NO4/c20-18(21)19-10-11-22-17(12-19)15-6-8-16(9-7-15)23-13-14-4-2-1-3-5-14/h1-9,17H,10-13H2,(H,20,21)/t17-/m0/s1
InChIKeyPPSWAXVFWXKMBG-KRWDZBQOSA-N
MW313.35 g/mol
LogP3.32
Rot. Bonds4

About (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid

(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid (PubChem CID 68617082) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid.

Molecular Properties

Compound Name(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid
PubChem CID68617082
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC Name(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid
SMILESO=C(O)N1CCO[C@H](c2ccc(OCc3ccccc3)cc2)C1
InChIInChI=1S/C18H19NO4/c20-18(21)19-10-11-22-17(12-19)15-6-8-16(9-7-15)23-13-14-4-2-1-3-5-14/h1-9,17H,10-13H2,(H,20,21)/t17-/m0/s1
InChIKeyPPSWAXVFWXKMBG-KRWDZBQOSA-N
XLogP3.32
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(4-chlorophenyl)morpholin-4-yl]-[4-(phenoxymethyl)phenyl]methanone
CID 55947511
2-(4-aminophenyl)morpholine-4-carboxylic acid
CID 66705901
(2S)-4-[(4-methoxyphenyl)methyl]-2-(4-phenylmethoxyphenyl)morpholine
CID 67352433
(2,2,2-trifluoroacetyl) 3-[2-(4-phenylmethoxyphenyl)morpholin-4-yl]propanoate
CID 87243620
(2S)-2-(4-cyanophenyl)morpholine-4-carboxylic acid
CID 66862110
2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
CID 25281339
2-(4-methoxyphenoxy)-1-[(2R)-2-phenylmorpholin-4-yl]ethanone
CID 25281342
(2S)-4-[(1S,2S)-2-(4-phenylmethoxyphenyl)cyclopropanecarbonyl]morpholine-2-carboxylic acid
CID 125153479
4-[2-oxo-2-[(2R)-2-phenylmorpholin-4-yl]ethoxy]benzamide
CID 94796760
2-[(2R)-4-[(1S,2R)-2-(4-phenylmethoxyphenyl)cyclopropanecarbonyl]morpholin-2-yl]acetic acid
CID 125134084
[5-[(4-fluorophenoxy)methyl]furan-2-yl]-[2-(4-fluorophenyl)morpholin-4-yl]methanone
CID 134044391
1-[2-(4-ethylphenyl)morpholin-4-yl]-4-phenoxybutan-1-one
CID 110364018

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid?
The IUPAC name of (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid (CID 68617082) is (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid.
What is the SMILES notation for (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid?
The canonical SMILES for (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid is O=C(O)N1CCO[C@H](c2ccc(OCc3ccccc3)cc2)C1.
What is the InChIKey of (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid?
The InChIKey is PPSWAXVFWXKMBG-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H19NO4/c20-18(21)19-10-11-22-17(12-19)15-6-8-16(9-7-15)23-13-14-4-2-1-3-5-14/h1-9,17H,10-13H2,(H,20,21)/t17-/m0/s1.
What are the key properties of (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid?
(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid has a molecular weight of 313.35 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid is sourced from PubChem (CID 68617082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).