5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one

C20H15N3O — CID 148508782

IUPAC5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one
SMILESO=c1ccc(C2=C(c3ccncc3)N=C(c3ccccc3)C2)c[nH]1
InChIInChI=1S/C20H15N3O/c24-19-7-6-16(13-22-19)17-12-18(14-4-2-1-3-5-14)23-20(17)15-8-10-21-11-9-15/h1-11,13H,12H2,(H,22,24)
InChIKeyMMBUYEGKDBOQQW-UHFFFAOYSA-N
MW313.36 g/mol
LogP3.53
Rot. Bonds3

About 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one

5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one (PubChem CID 148508782) has the molecular formula C20H15N3O and a molecular weight of 313.36 g/mol. Its IUPAC name is 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one
PubChem CID148508782
Molecular FormulaC20H15N3O
Molecular Weight313.36 g/mol
Exact Mass313.12
IUPAC Name5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one
SMILESO=c1ccc(C2=C(c3ccncc3)N=C(c3ccccc3)C2)c[nH]1
InChIInChI=1S/C20H15N3O/c24-19-7-6-16(13-22-19)17-12-18(14-4-2-1-3-5-14)23-20(17)15-8-10-21-11-9-15/h1-11,13H,12H2,(H,22,24)
InChIKeyMMBUYEGKDBOQQW-UHFFFAOYSA-N
XLogP3.53
TPSA58.11 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-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

2,4,5-triphenyl-3H-pyrrole
CID 143156770
2-chloro-5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)benzoic acid
CID 149359278
2-ethylsulfanyl-5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)benzoic acid
CID 147998284
5-phenyl-1H-pyridin-2-one
CID 10057963
4-fluoro-6-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-indazol-3-amine
CID 162041288
[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-3H-pyrrol-2-yl]phenyl]-dimethylsulfanium
CID 160716030
tris(4-[5-(4-fluorophenyl)-2-(4-methylphenyl)-3H-pyrrol-4-yl]pyridine);4-[2-[4-(2-methylpropyl)phenyl]-5-phenyl-3H-pyrrol-4-yl]pyridine;5-[2-[4-(2-methylpropyl)phenyl]-4-pyridin-4-yl-3H-pyrrol-5-yl]-2,1,3-benzoxadiazole
CID 159820079
2-[5-(4-fluorophenyl)-2-(4-methylphenyl)-3H-pyrrol-4-yl]pyridine
CID 158954454
ethane;5-pyridin-2-yl-1H-pyridin-2-one
CID 144524289
azane;4-phenylpyridine
CID 175775455
6-methyl-3-phenyl-6-pyridin-4-yl-1,2-dihydropyrazin-5-one
CID 51063172
5-phenyl-2-(pyridine-4-carbonyl)-4H-pyrazol-3-one
CID 4068588

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one?
The IUPAC name of 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one (CID 148508782) is 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one?
The canonical SMILES for 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one is O=c1ccc(C2=C(c3ccncc3)N=C(c3ccccc3)C2)c[nH]1.
What is the InChIKey of 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one?
The InChIKey is MMBUYEGKDBOQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O/c24-19-7-6-16(13-22-19)17-12-18(14-4-2-1-3-5-14)23-20(17)15-8-10-21-11-9-15/h1-11,13H,12H2,(H,22,24).
What are the key properties of 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one?
5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one has a molecular weight of 313.36 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenyl-5-pyridin-4-yl-3H-pyrrol-4-yl)-1H-pyridin-2-one is sourced from PubChem (CID 148508782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).