2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide

C22H25N3O — CID 10043307

IUPAC2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide
SMILESCC(C)c1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H25N3O/c1-17(2)20-24-14-16-25(20)15-13-22(21(23)26,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,14,16-17H,13,15H2,1-2H3,(H2,23,26)
InChIKeyLTTOUWNMTDVQKW-UHFFFAOYSA-N
MW347.46 g/mol
LogP3.87
Rot. Bonds7

About 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide

2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide (PubChem CID 10043307) has the molecular formula C22H25N3O and a molecular weight of 347.46 g/mol. Its IUPAC name is 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide.

Molecular Properties

Compound Name2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide
PubChem CID10043307
Molecular FormulaC22H25N3O
Molecular Weight347.46 g/mol
Exact Mass347.20
IUPAC Name2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide
SMILESCC(C)c1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H25N3O/c1-17(2)20-24-14-16-25(20)15-13-22(21(23)26,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,14,16-17H,13,15H2,1-2H3,(H2,23,26)
InChIKeyLTTOUWNMTDVQKW-UHFFFAOYSA-N
XLogP3.87
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide 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-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide?
The IUPAC name of 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide (CID 10043307) is 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide.
What is the SMILES notation for 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide?
The canonical SMILES for 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide is CC(C)c1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide?
The InChIKey is LTTOUWNMTDVQKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O/c1-17(2)20-24-14-16-25(20)15-13-22(21(23)26,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,14,16-17H,13,15H2,1-2H3,(H2,23,26).
What are the key properties of 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide?
2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide has a molecular weight of 347.46 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-4-(2-propan-2-ylimidazol-1-yl)butanamide is sourced from PubChem (CID 10043307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).