4-oxo-N,1,2-triphenylazetidine-2-carboxamide

C22H18N2O2 — CID 4564262

IUPAC4-oxo-N,1,2-triphenylazetidine-2-carboxamide
SMILESO=C1CC(C(=O)Nc2ccccc2)(c2ccccc2)N1c1ccccc1
InChIInChI=1S/C22H18N2O2/c25-20-16-22(17-10-4-1-5-11-17,24(20)19-14-8-3-9-15-19)21(26)23-18-12-6-2-7-13-18/h1-15H,16H2,(H,23,26)
InChIKeyNMMITAOSKDSEIR-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.96
Rot. Bonds4

About 4-oxo-N,1,2-triphenylazetidine-2-carboxamide

4-oxo-N,1,2-triphenylazetidine-2-carboxamide (PubChem CID 4564262) has the molecular formula C22H18N2O2 and a molecular weight of 342.40 g/mol. Its IUPAC name is 4-oxo-N,1,2-triphenylazetidine-2-carboxamide.

Molecular Properties

Compound Name4-oxo-N,1,2-triphenylazetidine-2-carboxamide
PubChem CID4564262
Molecular FormulaC22H18N2O2
Molecular Weight342.40 g/mol
Exact Mass342.14
IUPAC Name4-oxo-N,1,2-triphenylazetidine-2-carboxamide
SMILESO=C1CC(C(=O)Nc2ccccc2)(c2ccccc2)N1c1ccccc1
InChIInChI=1S/C22H18N2O2/c25-20-16-22(17-10-4-1-5-11-17,24(20)19-14-8-3-9-15-19)21(26)23-18-12-6-2-7-13-18/h1-15H,16H2,(H,23,26)
InChIKeyNMMITAOSKDSEIR-UHFFFAOYSA-N
XLogP3.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-oxo-N,1,2-triphenylazetidine-2-carboxamide 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,1-bis(4-chlorophenyl)-4-oxo-2-phenylazetidine-2-carboxamide
CID 4552745
(2R)-N-(2-methylphenyl)-4-oxo-1-phenyl-2-(4-propan-2-ylphenyl)azetidine-2-carboxamide
CID 7693230
(2R)-1-(4-methoxyphenyl)-N-(2-methylphenyl)-4-oxo-2-phenylazetidine-2-carboxamide
CID 7693726
2-(2-chlorophenyl)-N,1-bis(4-methylphenyl)-4-oxoazetidine-2-carboxamide
CID 3809536
N,1-bis(2-methylphenyl)-4-oxo-2-phenylazetidine-2-carboxamide
CID 3535232
N,1-bis(2-fluorophenyl)-4-oxo-2-phenylazetidine-2-carboxamide
CID 3756747
ethyl 4-[[1-(4-ethoxycarbonylphenyl)-2-(4-methylphenyl)-4-oxoazetidine-2-carbonyl]amino]benzoate
CID 3803032
(2R)-N-cyclopentyl-4-oxo-1-phenyl-2-thiophen-3-ylazetidine-2-carboxamide
CID 7693831
2-(2-methyl-1H-indol-3-yl)-N,1-bis(4-methylphenyl)-4-oxoazetidine-2-carboxamide
CID 3251424
N,1-bis(3-chlorophenyl)-2-(furan-2-yl)-4-oxoazetidine-2-carboxamide
CID 5190317
N,1-bis(2-fluorophenyl)-2-(4-fluorophenyl)-4-oxoazetidine-2-carboxamide
CID 3803037
1-chloro-N-phenylcyclopropane-1-carboxamide
CID 130016520

Frequently Asked Questions

What is the IUPAC name of 4-oxo-N,1,2-triphenylazetidine-2-carboxamide?
The IUPAC name of 4-oxo-N,1,2-triphenylazetidine-2-carboxamide (CID 4564262) is 4-oxo-N,1,2-triphenylazetidine-2-carboxamide.
What is the SMILES notation for 4-oxo-N,1,2-triphenylazetidine-2-carboxamide?
The canonical SMILES for 4-oxo-N,1,2-triphenylazetidine-2-carboxamide is O=C1CC(C(=O)Nc2ccccc2)(c2ccccc2)N1c1ccccc1.
What is the InChIKey of 4-oxo-N,1,2-triphenylazetidine-2-carboxamide?
The InChIKey is NMMITAOSKDSEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2/c25-20-16-22(17-10-4-1-5-11-17,24(20)19-14-8-3-9-15-19)21(26)23-18-12-6-2-7-13-18/h1-15H,16H2,(H,23,26).
What are the key properties of 4-oxo-N,1,2-triphenylazetidine-2-carboxamide?
4-oxo-N,1,2-triphenylazetidine-2-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-N,1,2-triphenylazetidine-2-carboxamide is sourced from PubChem (CID 4564262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).