2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid

C21H23NO4 — CID 129469743

IUPAC2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid
SMILESO=C(O)C[C@@H]1COCCN1C(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NO4/c23-20(22-11-12-26-15-18(22)13-21(24)25)14-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H,24,25)/t18-/m1/s1
InChIKeyFZQFTRCSVJVVMV-GOSISDBHSA-N
MW353.42 g/mol
LogP2.91
Rot. Bonds6

About 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid

2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid (PubChem CID 129469743) has the molecular formula C21H23NO4 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid
PubChem CID129469743
Molecular FormulaC21H23NO4
Molecular Weight353.42 g/mol
Exact Mass353.16
IUPAC Name2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid
SMILESO=C(O)C[C@@H]1COCCN1C(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NO4/c23-20(22-11-12-26-15-18(22)13-21(24)25)14-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H,24,25)/t18-/m1/s1
InChIKeyFZQFTRCSVJVVMV-GOSISDBHSA-N
XLogP2.91
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R)-4-[2-(1-benzylpiperidin-4-yl)acetyl]morpholin-3-yl]acetic acid
CID 124751060
1-(3-benzylmorpholin-4-yl)-3-methylbutan-1-one
CID 110749916
2-[(3R)-4-(2-pyridin-3-ylacetyl)morpholin-3-yl]acetic acid
CID 99622343
2-[4-[2-(2-phenylmethoxyphenyl)acetyl]morpholin-3-yl]acetic acid
CID 56915525
2-[(3S)-4-(pyridine-4-carbonyl)morpholin-3-yl]acetic acid
CID 124572359
2-[4-[2-[methyl(pyridin-2-ylmethyl)amino]acetyl]morpholin-3-yl]acetic acid
CID 118796116
2-[(3S)-4-(3-pyridin-3-ylpropanoyl)morpholin-3-yl]acetic acid
CID 99625562
2-[4-[3-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoyl]morpholin-3-yl]acetic acid
CID 165485648
2-[(3R)-4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetyl]morpholin-3-yl]acetic acid
CID 129469907
1-[3-(2-hydroxy-2-phenylethyl)morpholin-4-yl]prop-2-en-1-one
CID 166406225
2-[(3R)-4-(1-phenyl-1,2,4-triazole-3-carbonyl)morpholin-3-yl]acetic acid
CID 129469902
2-[4-(6-oxo-1H-pyridine-2-carbonyl)morpholin-3-yl]acetic acid
CID 114040095

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid?
The IUPAC name of 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid (CID 129469743) is 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid.
What is the SMILES notation for 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid?
The canonical SMILES for 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid is O=C(O)C[C@@H]1COCCN1C(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid?
The InChIKey is FZQFTRCSVJVVMV-GOSISDBHSA-N. The full InChI is InChI=1S/C21H23NO4/c23-20(22-11-12-26-15-18(22)13-21(24)25)14-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H,24,25)/t18-/m1/s1.
What are the key properties of 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid?
2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid has a molecular weight of 353.42 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-4-(3,3-diphenylpropanoyl)morpholin-3-yl]acetic acid is sourced from PubChem (CID 129469743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).