cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one

C27H27FN4O2 — CID 154641932

IUPACcyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one
SMILESNC(=O)C1CC1.O=C1CCC(c2ccccc2)N1c1ccc2c(c1)CNN2c1ccc(F)cc1
InChIInChI=1S/C23H20FN3O.C4H7NO/c24-18-6-8-19(9-7-18)27-22-11-10-20(14-17(22)15-25-27)26-21(12-13-23(26)28)16-4-2-1-3-5-16;5-4(6)3-1-2-3/h1-11,14,21,25H,12-13,15H2;3H,1-2H2,(H2,5,6)
InChIKeyFEZXXSMKOQQWLN-UHFFFAOYSA-N
MW458.54 g/mol
LogP4.73
Rot. Bonds4

About cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one

cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one (PubChem CID 154641932) has the molecular formula C27H27FN4O2 and a molecular weight of 458.54 g/mol. Its IUPAC name is cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one.

Molecular Properties

Compound Namecyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one
PubChem CID154641932
Molecular FormulaC27H27FN4O2
Molecular Weight458.54 g/mol
Exact Mass458.21
IUPAC Namecyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one
SMILESNC(=O)C1CC1.O=C1CCC(c2ccccc2)N1c1ccc2c(c1)CNN2c1ccc(F)cc1
InChIInChI=1S/C23H20FN3O.C4H7NO/c24-18-6-8-19(9-7-18)27-22-11-10-20(14-17(22)15-25-27)26-21(12-13-23(26)28)16-4-2-1-3-5-16;5-4(6)3-1-2-3/h1-11,14,21,25H,12-13,15H2;3H,1-2H2,(H2,5,6)
InChIKeyFEZXXSMKOQQWLN-UHFFFAOYSA-N
XLogP4.73
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.54
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3S)-1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]cyclopropanecarboxamide
CID 154993998
2-fluoro-6-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-7-phenyl-6-azaspiro[3.4]octan-5-one
CID 154993882
1-(4-fluorophenyl)-6-phenylpiperidin-2-one
CID 14576903
1-[3-amino-4-(N-amino-4-fluoroanilino)phenyl]-5-phenylpyrrolidin-2-one
CID 155744206
(5S)-1-[1-(4-fluorophenyl)imidazo[1,5-a]pyridin-6-yl]-5-phenylpyrrolidin-2-one
CID 155744225
5-(3-fluorophenyl)-1-[1-(4-fluorophenyl)indazol-5-yl]pyrrolidin-2-one
CID 166989402
1-(3-bromoimidazo[1,2-a]pyridin-6-yl)-5-(4-fluorophenyl)pyrrolidin-2-one
CID 171799346
5-(4-fluorophenyl)-1-(1-methylpyrazol-4-yl)pyrrolidin-2-one
CID 134691416
(2S)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 134861017
1-[(3S)-1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide
CID 683089
2,2,2-trifluoro-1-(4-methylsulfanylphenyl)-1-(1-phenyl-2,3-dihydroindazol-5-yl)ethanol
CID 143372120
1-(aminomethyl)-5-phenylpyrrolidin-2-one
CID 23348574

Frequently Asked Questions

What is the IUPAC name of cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one?
The IUPAC name of cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one (CID 154641932) is cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one.
What is the SMILES notation for cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one?
The canonical SMILES for cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one is NC(=O)C1CC1.O=C1CCC(c2ccccc2)N1c1ccc2c(c1)CNN2c1ccc(F)cc1.
What is the InChIKey of cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one?
The InChIKey is FEZXXSMKOQQWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FN3O.C4H7NO/c24-18-6-8-19(9-7-18)27-22-11-10-20(14-17(22)15-25-27)26-21(12-13-23(26)28)16-4-2-1-3-5-16;5-4(6)3-1-2-3/h1-11,14,21,25H,12-13,15H2;3H,1-2H2,(H2,5,6).
What are the key properties of cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one?
cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one has a molecular weight of 458.54 g/mol, XLogP of 4.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanecarboxamide;1-[1-(4-fluorophenyl)-2,3-dihydroindazol-5-yl]-5-phenylpyrrolidin-2-one is sourced from PubChem (CID 154641932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).