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

C21H24N2O3 — CID 92585376

IUPAC(2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide
SMILESCCC(=O)N1CCO[C@@](Cc2cccc(-c3ccccc3)c2)(C(N)=O)C1
InChIInChI=1S/C21H24N2O3/c1-2-19(24)23-11-12-26-21(15-23,20(22)25)14-16-7-6-10-18(13-16)17-8-4-3-5-9-17/h3-10,13H,2,11-12,14-15H2,1H3,(H2,22,25)/t21-/m1/s1
InChIKeyFWRGKSCKUZFGIG-OAQYLSRUSA-N
MW352.43 g/mol
LogP2.39
Rot. Bonds5

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

(2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide (PubChem CID 92585376) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide
PubChem CID92585376
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name(2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide
SMILESCCC(=O)N1CCO[C@@](Cc2cccc(-c3ccccc3)c2)(C(N)=O)C1
InChIInChI=1S/C21H24N2O3/c1-2-19(24)23-11-12-26-21(15-23,20(22)25)14-16-7-6-10-18(13-16)17-8-4-3-5-9-17/h3-10,13H,2,11-12,14-15H2,1H3,(H2,22,25)/t21-/m1/s1
InChIKeyFWRGKSCKUZFGIG-OAQYLSRUSA-N
XLogP2.39
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-methylbutanoyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
CID 110233107
(2R)-4-(2-methoxyacetyl)-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
CID 92610806
4-butanoyl-2-[[3-(4-methylphenyl)phenyl]methyl]morpholine-2-carboxamide
CID 110233206
(2S)-4-(3-phenylpropanoyl)-2-[(3-pyridin-4-ylphenyl)methyl]morpholine-2-carboxamide
CID 92574627
(2R)-4-butanoyl-2-[(4-phenylphenyl)methyl]morpholine-2-carboxamide
CID 92586577
(2S)-4-(3-methylbutanoyl)-2-[(3-pyridin-4-ylphenyl)methyl]morpholine-2-carboxamide
CID 92578987
(2S)-4-benzoyl-2-[(3-pyridin-4-ylphenyl)methyl]morpholine-2-carboxamide
CID 92574060
4-butanoyl-N-methyl-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
CID 110233131
4-butanoyl-N,N-dimethyl-2-[(3-phenylphenyl)methyl]morpholine-2-carboxamide
CID 110233150
4-butanoyl-2-[[4-(3-methylphenyl)phenyl]methyl]morpholine-2-carboxamide
CID 110233463
4-(3-methylbutanoyl)-2-[(3-pyridin-3-ylphenyl)methyl]morpholine-2-carboxamide
CID 110233047
(2R)-2-[[3-(3-fluorophenyl)phenyl]methyl]-4-(2-methylpropanoyl)morpholine-2-carboxamide
CID 95848920

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide?
The IUPAC name of (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide (CID 92585376) is (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide.
What is the SMILES notation for (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide?
The canonical SMILES for (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide is CCC(=O)N1CCO[C@@](Cc2cccc(-c3ccccc3)c2)(C(N)=O)C1.
What is the InChIKey of (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide?
The InChIKey is FWRGKSCKUZFGIG-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-2-19(24)23-11-12-26-21(15-23,20(22)25)14-16-7-6-10-18(13-16)17-8-4-3-5-9-17/h3-10,13H,2,11-12,14-15H2,1H3,(H2,22,25)/t21-/m1/s1.
What are the key properties of (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide?
(2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide has a molecular weight of 352.43 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(3-phenylphenyl)methyl]-4-propanoylmorpholine-2-carboxamide is sourced from PubChem (CID 92585376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).