(3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide

C24H22N2O3 — CID 40625044

IUPAC(3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1
InChIInChI=1S/C24H22N2O3/c27-23-15-19(17-26(23)16-18-9-3-1-4-10-18)24(28)25-21-13-7-8-14-22(21)29-20-11-5-2-6-12-20/h1-14,19H,15-17H2,(H,25,28)/t19-/m1/s1
InChIKeyRJMGQKKFLXIVMM-LJQANCHMSA-N
MW386.45 g/mol
LogP4.47
Rot. Bonds6

About (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide

(3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide (PubChem CID 40625044) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide
PubChem CID40625044
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name(3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1
InChIInChI=1S/C24H22N2O3/c27-23-15-19(17-26(23)16-18-9-3-1-4-10-18)24(28)25-21-13-7-8-14-22(21)29-20-11-5-2-6-12-20/h1-14,19H,15-17H2,(H,25,28)/t19-/m1/s1
InChIKeyRJMGQKKFLXIVMM-LJQANCHMSA-N
XLogP4.47
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-N-[2-(2-chlorophenoxy)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 24514266
(3R)-1-benzyl-N-(2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40602528
methyl 2-[[(3S)-1-benzyl-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 41118744
1-benzyl-5-oxo-N-(2-pyrrolidin-1-ylphenyl)pyrrolidine-3-carboxamide
CID 24979026
N-(5-chloro-2-phenoxyphenyl)-5-oxo-1-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 60529604
1-benzyl-N-(2-tert-butylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 17396518
1-(furan-2-ylmethyl)-N-[2-(4-methylphenoxy)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 42908533
(3S)-1-benzyl-N-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 34363990
(3S)-1-benzyl-N-(2,4-difluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 2372506
1-benzyl-N-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 42992516
1-[(4-methylphenyl)methyl]-5-oxo-N-[2-(phenoxymethyl)phenyl]pyrrolidine-3-carboxamide
CID 167901703
1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-2-carboxamide
CID 110426937

Frequently Asked Questions

What is the IUPAC name of (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide (CID 40625044) is (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide is O=C(Nc1ccccc1Oc1ccccc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1.
What is the InChIKey of (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide?
The InChIKey is RJMGQKKFLXIVMM-LJQANCHMSA-N. The full InChI is InChI=1S/C24H22N2O3/c27-23-15-19(17-26(23)16-18-9-3-1-4-10-18)24(28)25-21-13-7-8-14-22(21)29-20-11-5-2-6-12-20/h1-14,19H,15-17H2,(H,25,28)/t19-/m1/s1.
What are the key properties of (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide?
(3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 4.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-benzyl-5-oxo-N-(2-phenoxyphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 40625044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).