2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide

C26H34F2N2O — CID 19439907

IUPAC2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide
SMILESCC(C)CC(CN(C)C(=O)C(C)(c1ccc(F)cc1)c1ccc(F)cc1)N1CCCC1
InChIInChI=1S/C26H34F2N2O/c1-19(2)17-24(30-15-5-6-16-30)18-29(4)25(31)26(3,20-7-11-22(27)12-8-20)21-9-13-23(28)14-10-21/h7-14,19,24H,5-6,15-18H2,1-4H3
InChIKeyYVKAQBBITOHVKP-UHFFFAOYSA-N
MW428.57 g/mol
LogP5.24
Rot. Bonds8

About 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide

2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide (PubChem CID 19439907) has the molecular formula C26H34F2N2O and a molecular weight of 428.57 g/mol. Its IUPAC name is 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide.

Molecular Properties

Compound Name2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide
PubChem CID19439907
Molecular FormulaC26H34F2N2O
Molecular Weight428.57 g/mol
Exact Mass428.26
IUPAC Name2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide
SMILESCC(C)CC(CN(C)C(=O)C(C)(c1ccc(F)cc1)c1ccc(F)cc1)N1CCCC1
InChIInChI=1S/C26H34F2N2O/c1-19(2)17-24(30-15-5-6-16-30)18-29(4)25(31)26(3,20-7-11-22(27)12-8-20)21-9-13-23(28)14-10-21/h7-14,19,24H,5-6,15-18H2,1-4H3
InChIKeyYVKAQBBITOHVKP-UHFFFAOYSA-N
XLogP5.24
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.57
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide 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 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide?
The IUPAC name of 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide (CID 19439907) is 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide.
What is the SMILES notation for 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide?
The canonical SMILES for 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide is CC(C)CC(CN(C)C(=O)C(C)(c1ccc(F)cc1)c1ccc(F)cc1)N1CCCC1.
What is the InChIKey of 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide?
The InChIKey is YVKAQBBITOHVKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34F2N2O/c1-19(2)17-24(30-15-5-6-16-30)18-29(4)25(31)26(3,20-7-11-22(27)12-8-20)21-9-13-23(28)14-10-21/h7-14,19,24H,5-6,15-18H2,1-4H3.
What are the key properties of 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide?
2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide has a molecular weight of 428.57 g/mol, XLogP of 5.24, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(4-fluorophenyl)-N-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)propanamide is sourced from PubChem (CID 19439907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).