(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide

C21H24N2O4 — CID 92610806

IUPAC(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
SMILESCOCC(=O)N1CCO[C@@](Cc2cccc(-c3ccccc3)c2)(C(N)=O)C1
InChIInChI=1S/C21H24N2O4/c1-26-14-19(24)23-10-11-27-21(15-23,20(22)25)13-16-6-5-9-18(12-16)17-7-3-2-4-8-17/h2-9,12H,10-11,13-15H2,1H3,(H2,22,25)/t21-/m1/s1
InChIKeyAGMTYHSLURVWQA-OAQYLSRUSA-N
MW368.43 g/mol
LogP1.63
Rot. Bonds6

About (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide

(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide (PubChem CID 92610806) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
PubChem CID92610806
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC Name(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
SMILESCOCC(=O)N1CCO[C@@](Cc2cccc(-c3ccccc3)c2)(C(N)=O)C1
InChIInChI=1S/C21H24N2O4/c1-26-14-19(24)23-10-11-27-21(15-23,20(22)25)13-16-6-5-9-18(12-16)17-7-3-2-4-8-17/h2-9,12H,10-11,13-15H2,1H3,(H2,22,25)/t21-/m1/s1
InChIKeyAGMTYHSLURVWQA-OAQYLSRUSA-N
XLogP1.63
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide?
The IUPAC name of (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide (CID 92610806) is (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide.
What is the SMILES notation for (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide?
The canonical SMILES for (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide is COCC(=O)N1CCO[C@@](Cc2cccc(-c3ccccc3)c2)(C(N)=O)C1.
What is the InChIKey of (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide?
The InChIKey is AGMTYHSLURVWQA-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H24N2O4/c1-26-14-19(24)23-10-11-27-21(15-23,20(22)25)13-16-6-5-9-18(12-16)17-7-3-2-4-8-17/h2-9,12H,10-11,13-15H2,1H3,(H2,22,25)/t21-/m1/s1.
What are the key properties of (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide?
(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide has a molecular weight of 368.43 g/mol, XLogP of 1.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide is sourced from PubChem (CID 92610806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).