ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one

C13H16N2O2 — CID 168939177

IUPACethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one
SMILESCC.Cc1cccc(On2ccccc2=O)n1
InChIInChI=1S/C11H10N2O2.C2H6/c1-9-5-4-6-10(12-9)15-13-8-3-2-7-11(13)14;1-2/h2-8H,1H3;1-2H3
InChIKeyPGRDGMIZDTZEQO-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.42
Rot. Bonds2

About ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one

ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one (PubChem CID 168939177) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one.

Molecular Properties

Compound Nameethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one
PubChem CID168939177
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Nameethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one
SMILESCC.Cc1cccc(On2ccccc2=O)n1
InChIInChI=1S/C11H10N2O2.C2H6/c1-9-5-4-6-10(12-9)15-13-8-3-2-7-11(13)14;1-2/h2-8H,1H3;1-2H3
InChIKeyPGRDGMIZDTZEQO-UHFFFAOYSA-N
XLogP2.42
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one?
The IUPAC name of ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one (CID 168939177) is ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one.
What is the SMILES notation for ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one?
The canonical SMILES for ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one is CC.Cc1cccc(On2ccccc2=O)n1.
What is the InChIKey of ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one?
The InChIKey is PGRDGMIZDTZEQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2.C2H6/c1-9-5-4-6-10(12-9)15-13-8-3-2-7-11(13)14;1-2/h2-8H,1H3;1-2H3.
What are the key properties of ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one?
ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one has a molecular weight of 232.28 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one is sourced from PubChem (CID 168939177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).