2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide

C25H26N2O — CID 57119129

IUPAC2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide
SMILESNC(=O)CC1CCN(Cc2ccccc2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O/c26-24(28)18-23-16-17-27(19-20-10-4-1-5-11-20)25(23,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,23H,16-19H2,(H2,26,28)
InChIKeyYDRHBWUCCYCAGT-UHFFFAOYSA-N
MW370.50 g/mol
LogP4.33
Rot. Bonds6

About 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide

2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide (PubChem CID 57119129) has the molecular formula C25H26N2O and a molecular weight of 370.50 g/mol. Its IUPAC name is 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide
PubChem CID57119129
Molecular FormulaC25H26N2O
Molecular Weight370.50 g/mol
Exact Mass370.20
IUPAC Name2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide
SMILESNC(=O)CC1CCN(Cc2ccccc2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O/c26-24(28)18-23-16-17-27(19-20-10-4-1-5-11-20)25(23,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,23H,16-19H2,(H2,26,28)
InChIKeyYDRHBWUCCYCAGT-UHFFFAOYSA-N
XLogP4.33
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide?
The IUPAC name of 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide (CID 57119129) is 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide?
The canonical SMILES for 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide is NC(=O)CC1CCN(Cc2ccccc2)C1(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide?
The InChIKey is YDRHBWUCCYCAGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O/c26-24(28)18-23-16-17-27(19-20-10-4-1-5-11-20)25(23,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,23H,16-19H2,(H2,26,28).
What are the key properties of 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide?
2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide has a molecular weight of 370.50 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 57119129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).