5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide

C24H22N2O3 — CID 17080562

IUPAC5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)C1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C24H22N2O3/c27-23-15-19(16-26(23)21-9-5-2-6-10-21)24(28)25-20-11-13-22(14-12-20)29-17-18-7-3-1-4-8-18/h1-14,19H,15-17H2,(H,25,28)
InChIKeyOBSUHYRMXGIEEL-UHFFFAOYSA-N
MW386.45 g/mol
LogP4.26
Rot. Bonds6

About 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide

5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide (PubChem CID 17080562) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
PubChem CID17080562
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)C1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C24H22N2O3/c27-23-15-19(16-26(23)21-9-5-2-6-10-21)24(28)25-20-11-13-22(14-12-20)29-17-18-7-3-1-4-8-18/h1-14,19H,15-17H2,(H,25,28)
InChIKeyOBSUHYRMXGIEEL-UHFFFAOYSA-N
XLogP4.26
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 ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide (CID 17080562) is 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide is O=C(Nc1ccc(OCc2ccccc2)cc1)C1CC(=O)N(c2ccccc2)C1.
What is the InChIKey of 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
The InChIKey is OBSUHYRMXGIEEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c27-23-15-19(16-26(23)21-9-5-2-6-10-21)24(28)25-20-11-13-22(14-12-20)29-17-18-7-3-1-4-8-18/h1-14,19H,15-17H2,(H,25,28).
What are the key properties of 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 17080562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).