4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one

C22H19N3O2 — CID 170715914

IUPAC4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one
SMILESO=C1CN(C(=O)c2cc(-c3ccccc3)c(-c3ccccc3)cn2)CCN1
InChIInChI=1S/C22H19N3O2/c26-21-15-25(12-11-23-21)22(27)20-13-18(16-7-3-1-4-8-16)19(14-24-20)17-9-5-2-6-10-17/h1-10,13-14H,11-12,15H2,(H,23,26)
InChIKeyYDTVEBUEMTVADA-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.99
Rot. Bonds3

About 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one

4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one (PubChem CID 170715914) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one
PubChem CID170715914
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC Name4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one
SMILESO=C1CN(C(=O)c2cc(-c3ccccc3)c(-c3ccccc3)cn2)CCN1
InChIInChI=1S/C22H19N3O2/c26-21-15-25(12-11-23-21)22(27)20-13-18(16-7-3-1-4-8-16)19(14-24-20)17-9-5-2-6-10-17/h1-10,13-14H,11-12,15H2,(H,23,26)
InChIKeyYDTVEBUEMTVADA-UHFFFAOYSA-N
XLogP2.99
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one 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

4-(2-phenyl-1,3-thiazole-4-carbonyl)piperazin-2-one
CID 47123816
4-[5-(4-fluorophenyl)-4-phenylfuran-2-carbonyl]piperazin-2-one
CID 46832587
4-(6-fluoropyridine-2-carbonyl)piperazin-2-one
CID 115496615
4-[5-(3-chlorophenyl)-1,2-oxazole-3-carbonyl]piperazin-2-one
CID 37338263
4-(4,5-diphenyl-1,3-thiazole-2-carbonyl)piperazin-2-one
CID 170715907
4-(6-aminopyridine-2-carbonyl)piperazin-2-one;hydrochloride
CID 119998920
4-(2-bromopyridine-3-carbonyl)piperazin-2-one
CID 103753853
4-[5-[(E)-2-(1H-indazol-3-yl)ethenyl]pyridine-2-carbonyl]piperazin-2-one
CID 25055718
3-(3-oxopiperazine-1-carbonyl)benzaldehyde
CID 90105088
4-[2-(pyridin-2-ylamino)-1,3-thiazole-4-carbonyl]piperazin-2-one
CID 90509889
4-(3-iodobenzoyl)piperazin-2-one
CID 10381947
4-(pyrazine-2-carbonyl)-1,4-diazepan-2-one
CID 62896264

Frequently Asked Questions

What is the IUPAC name of 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one?
The IUPAC name of 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one (CID 170715914) is 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one.
What is the SMILES notation for 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one?
The canonical SMILES for 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one is O=C1CN(C(=O)c2cc(-c3ccccc3)c(-c3ccccc3)cn2)CCN1.
What is the InChIKey of 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one?
The InChIKey is YDTVEBUEMTVADA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c26-21-15-25(12-11-23-21)22(27)20-13-18(16-7-3-1-4-8-16)19(14-24-20)17-9-5-2-6-10-17/h1-10,13-14H,11-12,15H2,(H,23,26).
What are the key properties of 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one?
4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one has a molecular weight of 357.41 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-diphenylpyridine-2-carbonyl)piperazin-2-one is sourced from PubChem (CID 170715914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).