1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one

C23H19N3O3 — CID 163940144

IUPAC1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one
SMILESCn1cc(CC(=O)c2cnc(-c3cccc(Oc4ccccc4)c3)[nH]2)ccc1=O
InChIInChI=1S/C23H19N3O3/c1-26-15-16(10-11-22(26)28)12-21(27)20-14-24-23(25-20)17-6-5-9-19(13-17)29-18-7-3-2-4-8-18/h2-11,13-15H,12H2,1H3,(H,24,25)
InChIKeyLVNKWXWROXUHFG-UHFFFAOYSA-N
MW385.42 g/mol
LogP3.99
Rot. Bonds6

About 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one

1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one (PubChem CID 163940144) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one
PubChem CID163940144
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC Name1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one
SMILESCn1cc(CC(=O)c2cnc(-c3cccc(Oc4ccccc4)c3)[nH]2)ccc1=O
InChIInChI=1S/C23H19N3O3/c1-26-15-16(10-11-22(26)28)12-21(27)20-14-24-23(25-20)17-6-5-9-19(13-17)29-18-7-3-2-4-8-18/h2-11,13-15H,12H2,1H3,(H,24,25)
InChIKeyLVNKWXWROXUHFG-UHFFFAOYSA-N
XLogP3.99
TPSA76.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one with MolForge

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Related Compounds

2-(1,3-dihydro-2-benzofuran-5-yl)-1-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethanone
CID 163940147
1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]ethyl]pyridin-2-one
CID 163940142
2-(1,3-dihydro-2-benzofuran-5-yl)-1-[5-(3-phenoxyphenyl)-3H-pyrrol-2-yl]ethanone;1-methyl-5-[2-oxo-2-[5-(3-phenoxyphenyl)-3H-pyrrol-2-yl]ethyl]pyridin-2-one
CID 163722718
N-(1-methyl-6-oxo-3-pyridinyl)-5-(3-phenoxyphenyl)-1H-imidazole-2-carboxamide
CID 163529655
2-(3-ethoxyphenyl)-1H-imidazole-5-carboxylic acid
CID 62252661
methyl 2-[3-(trifluoromethoxy)phenyl]-1H-imidazole-5-carboxylate
CID 107105199
1-[5-(3-phenoxyphenyl)-3H-pyrrol-2-yl]-2-phenylethanone
CID 163595290
5-(3-methoxyphenyl)-1-methyl-N-[(3-phenoxyphenyl)methyl]imidazol-2-amine;oxalic acid
CID 163327777
2-[4-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]phenyl]-1-(1,3-thiazol-4-yl)ethanone
CID 157315843
2-[[2-(3-phenoxyphenyl)acetyl]amino]propanoic acid
CID 162228691
1-[2-(3-phenoxyphenyl)-1,3-thiazol-5-yl]ethanone
CID 62652088
methyl 2-(3-phenoxyphenyl)-3H-benzimidazole-5-carboxylate
CID 91902843

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one?
The IUPAC name of 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one (CID 163940144) is 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one.
What is the SMILES notation for 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one?
The canonical SMILES for 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one is Cn1cc(CC(=O)c2cnc(-c3cccc(Oc4ccccc4)c3)[nH]2)ccc1=O.
What is the InChIKey of 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one?
The InChIKey is LVNKWXWROXUHFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-26-15-16(10-11-22(26)28)12-21(27)20-14-24-23(25-20)17-6-5-9-19(13-17)29-18-7-3-2-4-8-18/h2-11,13-15H,12H2,1H3,(H,24,25).
What are the key properties of 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one?
1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one has a molecular weight of 385.42 g/mol, XLogP of 3.99, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[2-oxo-2-[2-(3-phenoxyphenyl)-1H-imidazol-5-yl]ethyl]pyridin-2-one is sourced from PubChem (CID 163940144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).