2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide

C24H24N2O3 — CID 51361521

IUPAC2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide
SMILESCC1(C(=O)Nc2ccc3ccccc3c2)CCC(=O)N1CCOc1ccccc1
InChIInChI=1S/C24H24N2O3/c1-24(23(28)25-20-12-11-18-7-5-6-8-19(18)17-20)14-13-22(27)26(24)15-16-29-21-9-3-2-4-10-21/h2-12,17H,13-16H2,1H3,(H,25,28)
InChIKeyFVHGLBWADKZGMS-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.24
Rot. Bonds6

About 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide

2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide (PubChem CID 51361521) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide
PubChem CID51361521
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide
SMILESCC1(C(=O)Nc2ccc3ccccc3c2)CCC(=O)N1CCOc1ccccc1
InChIInChI=1S/C24H24N2O3/c1-24(23(28)25-20-12-11-18-7-5-6-8-19(18)17-20)14-13-22(27)26(24)15-16-29-21-9-3-2-4-10-21/h2-12,17H,13-16H2,1H3,(H,25,28)
InChIKeyFVHGLBWADKZGMS-UHFFFAOYSA-N
XLogP4.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide (CID 51361521) is 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide is CC1(C(=O)Nc2ccc3ccccc3c2)CCC(=O)N1CCOc1ccccc1.
What is the InChIKey of 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide?
The InChIKey is FVHGLBWADKZGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-24(23(28)25-20-12-11-18-7-5-6-8-19(18)17-20)14-13-22(27)26(24)15-16-29-21-9-3-2-4-10-21/h2-12,17H,13-16H2,1H3,(H,25,28).
What are the key properties of 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide?
2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-naphthalen-2-yl-5-oxo-1-(2-phenoxyethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 51361521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).