N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide

C23H22F3N5O2 — CID 118937832

IUPACN-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide
SMILESO=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)NC1CCC(F)(F)C1
InChIInChI=1S/C23H22F3N5O2/c24-17-4-1-2-5-20(17)31-19-7-3-6-18(16(19)13-27-31)30-11-10-29(22(30)33)14-21(32)28-15-8-9-23(25,26)12-15/h1-7,13,15H,8-12,14H2,(H,28,32)
InChIKeyUREJLXNALDLNHY-UHFFFAOYSA-N
MW457.46 g/mol
LogP3.71
Rot. Bonds5

About N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide

N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide (PubChem CID 118937832) has the molecular formula C23H22F3N5O2 and a molecular weight of 457.46 g/mol. Its IUPAC name is N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide
PubChem CID118937832
Molecular FormulaC23H22F3N5O2
Molecular Weight457.46 g/mol
Exact Mass457.17
IUPAC NameN-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide
SMILESO=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)NC1CCC(F)(F)C1
InChIInChI=1S/C23H22F3N5O2/c24-17-4-1-2-5-20(17)31-19-7-3-6-18(16(19)13-27-31)30-11-10-29(22(30)33)14-21(32)28-15-8-9-23(25,26)12-15/h1-7,13,15H,8-12,14H2,(H,28,32)
InChIKeyUREJLXNALDLNHY-UHFFFAOYSA-N
XLogP3.71
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.46
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide (CID 118937832) is N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide is O=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)NC1CCC(F)(F)C1.
What is the InChIKey of N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide?
The InChIKey is UREJLXNALDLNHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F3N5O2/c24-17-4-1-2-5-20(17)31-19-7-3-6-18(16(19)13-27-31)30-11-10-29(22(30)33)14-21(32)28-15-8-9-23(25,26)12-15/h1-7,13,15H,8-12,14H2,(H,28,32).
What are the key properties of N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide?
N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide has a molecular weight of 457.46 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluorocyclopentyl)-2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 118937832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).