N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide

C24H21FN2O2 — CID 7255404

IUPACN-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide
SMILESO=C(N[C@@H]1CC(=O)N(c2cccc(F)c2)C1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H21FN2O2/c25-19-12-7-13-21(14-19)27-16-20(15-22(27)28)26-24(29)23(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-14,20,23H,15-16H2,(H,26,29)/t20-/m1/s1
InChIKeyBCVYWAYZAFEYKH-HXUWFJFHSA-N
MW388.44 g/mol
LogP3.88
Rot. Bonds5

About N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide

N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide (PubChem CID 7255404) has the molecular formula C24H21FN2O2 and a molecular weight of 388.44 g/mol. Its IUPAC name is N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide
PubChem CID7255404
Molecular FormulaC24H21FN2O2
Molecular Weight388.44 g/mol
Exact Mass388.16
IUPAC NameN-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide
SMILESO=C(N[C@@H]1CC(=O)N(c2cccc(F)c2)C1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H21FN2O2/c25-19-12-7-13-21(14-19)27-16-20(15-22(27)28)26-24(29)23(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-14,20,23H,15-16H2,(H,26,29)/t20-/m1/s1
InChIKeyBCVYWAYZAFEYKH-HXUWFJFHSA-N
XLogP3.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.44
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenylacetamide
CID 43971138
1-benzyl-3-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7547224
2-chloro-N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7563337
1-cyclopentyl-3-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 43970168
N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
CID 43971095
N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]pyrrolidine-1-carboxamide
CID 7546804
1-(2,4-difluorophenyl)-3-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 43970198
1-(2,5-difluorophenyl)-3-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7547407
1-(4-fluorophenyl)-3-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7547338
N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide
CID 7255350
1-ethyl-3-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7546969
N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide
CID 7255351

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide?
The IUPAC name of N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide (CID 7255404) is N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide?
The canonical SMILES for N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide is O=C(N[C@@H]1CC(=O)N(c2cccc(F)c2)C1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide?
The InChIKey is BCVYWAYZAFEYKH-HXUWFJFHSA-N. The full InChI is InChI=1S/C24H21FN2O2/c25-19-12-7-13-21(14-19)27-16-20(15-22(27)28)26-24(29)23(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-14,20,23H,15-16H2,(H,26,29)/t20-/m1/s1.
What are the key properties of N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide?
N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide has a molecular weight of 388.44 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2,2-diphenylacetamide is sourced from PubChem (CID 7255404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).