N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide

C25H23N3O3 — CID 108757719

IUPACN-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)N1CC(C(=O)Nc2oc(-c3ccccc3)c(-c3ccccc3)c2C#N)CC1=O
InChIInChI=1S/C25H23N3O3/c1-16(2)28-15-19(13-21(28)29)24(30)27-25-20(14-26)22(17-9-5-3-6-10-17)23(31-25)18-11-7-4-8-12-18/h3-12,16,19H,13,15H2,1-2H3,(H,27,30)
InChIKeyFMZKMOCGRLDWJH-UHFFFAOYSA-N
MW413.48 g/mol
LogP4.68
Rot. Bonds5

About N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide

N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 108757719) has the molecular formula C25H23N3O3 and a molecular weight of 413.48 g/mol. Its IUPAC name is N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID108757719
Molecular FormulaC25H23N3O3
Molecular Weight413.48 g/mol
Exact Mass413.17
IUPAC NameN-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
SMILESCC(C)N1CC(C(=O)Nc2oc(-c3ccccc3)c(-c3ccccc3)c2C#N)CC1=O
InChIInChI=1S/C25H23N3O3/c1-16(2)28-15-19(13-21(28)29)24(30)27-25-20(14-26)22(17-9-5-3-6-10-17)23(31-25)18-11-7-4-8-12-18/h3-12,16,19H,13,15H2,1-2H3,(H,27,30)
InChIKeyFMZKMOCGRLDWJH-UHFFFAOYSA-N
XLogP4.68
TPSA86.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide with MolForge

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Related Compounds

1-tert-butyl-N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 108757718
N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 2980638
N-(3-cyano-4,5-diphenylfuran-2-yl)-2,2,2-trifluoroacetamide
CID 1102939
(3S)-N-benzhydryl-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 9400697
(2S)-N-[3-cyano-4,5-bis(4-methylphenyl)furan-2-yl]-2-phenoxypropanamide
CID 2422829
N-(4-cyano-1-pyridin-2-ylpyrazol-5-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108760984
(3R)-N-(2-carbamoylphenyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 9401166
N-(3-cyano-4,5-diphenylfuran-2-yl)methanesulfonamide
CID 108781743
methyl 2-[[(3S)-5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl]amino]benzoate
CID 9401051
methyl 2-[[(3R)-5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl]amino]benzoate
CID 9401047
5-oxo-1-propan-2-yl-N-(4-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 2951809
(3S)-N-(benzhydrylideneamino)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 95275334

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide (CID 108757719) is N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide is CC(C)N1CC(C(=O)Nc2oc(-c3ccccc3)c(-c3ccccc3)c2C#N)CC1=O.
What is the InChIKey of N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is FMZKMOCGRLDWJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O3/c1-16(2)28-15-19(13-21(28)29)24(30)27-25-20(14-26)22(17-9-5-3-6-10-17)23(31-25)18-11-7-4-8-12-18/h3-12,16,19H,13,15H2,1-2H3,(H,27,30).
What are the key properties of N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide?
N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 413.48 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-4,5-diphenylfuran-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 108757719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).