3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one

C26H24N6O4 — CID 23145328

IUPAC3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one
SMILESCC(=O)N1CCCC1c1cc2[nH]c(-c3ccccn3)nc2cc1Oc1ccc(N2CCOC2=O)nc1
InChIInChI=1S/C26H24N6O4/c1-16(33)31-10-4-6-22(31)18-13-20-21(30-25(29-20)19-5-2-3-9-27-19)14-23(18)36-17-7-8-24(28-15-17)32-11-12-35-26(32)34/h2-3,5,7-9,13-15,22H,4,6,10-12H2,1H3,(H,29,30)
InChIKeyIGRSMOVFDYVJRF-UHFFFAOYSA-N
MW484.52 g/mol
LogP4.45
Rot. Bonds5

About 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one

3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one (PubChem CID 23145328) has the molecular formula C26H24N6O4 and a molecular weight of 484.52 g/mol. Its IUPAC name is 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one
PubChem CID23145328
Molecular FormulaC26H24N6O4
Molecular Weight484.52 g/mol
Exact Mass484.19
IUPAC Name3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one
SMILESCC(=O)N1CCCC1c1cc2[nH]c(-c3ccccn3)nc2cc1Oc1ccc(N2CCOC2=O)nc1
InChIInChI=1S/C26H24N6O4/c1-16(33)31-10-4-6-22(31)18-13-20-21(30-25(29-20)19-5-2-3-9-27-19)14-23(18)36-17-7-8-24(28-15-17)32-11-12-35-26(32)34/h2-3,5,7-9,13-15,22H,4,6,10-12H2,1H3,(H,29,30)
InChIKeyIGRSMOVFDYVJRF-UHFFFAOYSA-N
XLogP4.45
TPSA113.54 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.52
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one with MolForge

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Related Compounds

1-[2-[6-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 23145233
1-[2-[6-(4-pyrazin-2-ylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 23145202
1-[2-[6-[4-(1,3-oxazol-4-yl)phenoxy]-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 23145517
1-[2-[2-pyridin-2-yl-6-[4-(pyrrolidine-1-carbonyl)phenoxy]-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 23145126
1-[2-[6-(3-fluoro-4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 23145182
1-[(2R)-2-[5-[[6-(2-hydroxyethoxy)-3-pyridinyl]oxy]-2-pyridin-2-yl-1H-indol-6-yl]pyrrolidin-1-yl]ethanone
CID 44815643
1-[(2R,4R)-4-hydroxy-2-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 67482427
methyl 6-[6-(1-acetylpyrrolidin-2-yl)-5-(4-methylsulfonylphenoxy)-1H-benzimidazol-2-yl]pyridine-3-carboxylate
CID 23145539
1-[(2S,4S)-4-fluoro-2-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]pyrrolidin-1-yl]ethanone
CID 67482526
N-methyl-2-[4-[[6-(5-oxooxolan-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]phenyl]acetamide
CID 46180879
1-[(2R)-2-[5-[[6-(methoxymethyl)-3-pyridinyl]oxy]-2-pyrazin-2-yl-1H-indol-6-yl]pyrrolidin-1-yl]ethanone
CID 44815983
1-[5-[[6-[(2R)-1-acetylpyrrolidin-2-yl]-2-pyrazin-2-yl-1H-indol-5-yl]oxy]-2-pyridinyl]butan-1-one
CID 149040417

Frequently Asked Questions

What is the IUPAC name of 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one (CID 23145328) is 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one is CC(=O)N1CCCC1c1cc2[nH]c(-c3ccccn3)nc2cc1Oc1ccc(N2CCOC2=O)nc1.
What is the InChIKey of 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one?
The InChIKey is IGRSMOVFDYVJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N6O4/c1-16(33)31-10-4-6-22(31)18-13-20-21(30-25(29-20)19-5-2-3-9-27-19)14-23(18)36-17-7-8-24(28-15-17)32-11-12-35-26(32)34/h2-3,5,7-9,13-15,22H,4,6,10-12H2,1H3,(H,29,30).
What are the key properties of 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one?
3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one has a molecular weight of 484.52 g/mol, XLogP of 4.45, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[[6-(1-acetylpyrrolidin-2-yl)-2-pyridin-2-yl-1H-benzimidazol-5-yl]oxy]-2-pyridinyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 23145328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).