3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one

C20H18N4O2 — CID 66962388

IUPAC3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one
SMILESO=C1OCCN1C(c1ccccn1)C(c1cccnc1)c1cccnc1
InChIInChI=1S/C20H18N4O2/c25-20-24(11-12-26-20)19(17-7-1-2-10-23-17)18(15-5-3-8-21-13-15)16-6-4-9-22-14-16/h1-10,13-14,18-19H,11-12H2
InChIKeyAUELUODFEHEWJK-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.20
Rot. Bonds5

About 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one

3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one (PubChem CID 66962388) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one
PubChem CID66962388
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC Name3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one
SMILESO=C1OCCN1C(c1ccccn1)C(c1cccnc1)c1cccnc1
InChIInChI=1S/C20H18N4O2/c25-20-24(11-12-26-20)19(17-7-1-2-10-23-17)18(15-5-3-8-21-13-15)16-6-4-9-22-14-16/h1-10,13-14,18-19H,11-12H2
InChIKeyAUELUODFEHEWJK-UHFFFAOYSA-N
XLogP3.20
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one with MolForge

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Related Compounds

3-(2-hydroxy-1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one
CID 11545041
(S)-pyridin-2-yl(pyridin-3-yl)methanamine
CID 86315357
(S)-pyridin-2-yl(pyridin-3-yl)methanol
CID 86315351
3-[1-(4-fluorophenyl)-2-hydroxy-2,2-dipyridin-3-ylethyl]-1,3-oxazolidin-2-one
CID 11696556
bis(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine)
CID 158875666
methyl N-[6-(1-morpholin-4-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]carbamate
CID 91421264
4-[1-(3-chlorophenyl)-2,2-dipyridin-3-ylethyl]morpholine
CID 66962797
3-[(1S,2R)-2-pyridin-3-yl-1,2-dipyrrolidin-1-ylethyl]pyridine
CID 11163071
cumene;ethane;2-propan-2-ylpyridine;3-propan-2-ylpyridine
CID 159528038
tert-butyl N-[6-(1-morpholin-4-yl-2,2-dipyridin-3-ylethyl)-2-pyridinyl]carbamate
CID 90939785
4-[1-(2,3-dichlorophenyl)-2,2-dipyridin-3-ylethyl]morpholine
CID 69009942
cumene;ethane;1-propan-2-ylpiperidin-2-one;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;1-propan-2-ylpyrrolidin-2-one
CID 159188191

Frequently Asked Questions

What is the IUPAC name of 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one (CID 66962388) is 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one is O=C1OCCN1C(c1ccccn1)C(c1cccnc1)c1cccnc1.
What is the InChIKey of 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one?
The InChIKey is AUELUODFEHEWJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O2/c25-20-24(11-12-26-20)19(17-7-1-2-10-23-17)18(15-5-3-8-21-13-15)16-6-4-9-22-14-16/h1-10,13-14,18-19H,11-12H2.
What are the key properties of 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one?
3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one has a molecular weight of 346.39 g/mol, XLogP of 3.20, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 66962388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).