1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one

C11H16N2O2 — CID 84676149

IUPAC1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one
SMILESCc1c(OC2CCNC2)c(=O)ccn1C
InChIInChI=1S/C11H16N2O2/c1-8-11(10(14)4-6-13(8)2)15-9-3-5-12-7-9/h4,6,9,12H,3,5,7H2,1-2H3
InChIKeyWUWOKROJMHWRTA-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.43
Rot. Bonds2

About 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one

1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one (PubChem CID 84676149) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one.

Molecular Properties

Compound Name1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one
PubChem CID84676149
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one
SMILESCc1c(OC2CCNC2)c(=O)ccn1C
InChIInChI=1S/C11H16N2O2/c1-8-11(10(14)4-6-13(8)2)15-9-3-5-12-7-9/h4,6,9,12H,3,5,7H2,1-2H3
InChIKeyWUWOKROJMHWRTA-UHFFFAOYSA-N
XLogP0.43
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Aminomethyl-5-(2-pyrrolidin-1-yl-ethoxy)-pyridin-4-ol
CID 59300403
2-(chloromethyl)-5-(2-pyrrolidin-1-ylethoxy)-1H-pyridin-4-one
CID 82063829
2-(hydroxymethyl)-5-(2-pyrrolidin-1-ylethoxy)-1H-pyridin-4-one
CID 82063899
2-methyl-3-(2-oxo-2-pyrrolidin-1-ylethoxy)-1H-pyridin-4-one
CID 82064552
N,N-diethyl-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
CID 82064557
2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N,N-dipropylacetamide
CID 82064559
N-butyl-N-methyl-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
CID 82064561
N-butyl-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
CID 82064565
2-methyl-3-(2-pyrrolidin-1-ylethoxy)-1H-pyridin-4-one
CID 82064658
2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-propylacetamide
CID 82064662
3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one
CID 82064665
2-methyl-3-(2-piperidin-1-ylethoxy)-1H-pyridin-4-one
CID 82064669

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one?
The IUPAC name of 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one (CID 84676149) is 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one.
What is the SMILES notation for 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one?
The canonical SMILES for 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one is Cc1c(OC2CCNC2)c(=O)ccn1C.
What is the InChIKey of 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one?
The InChIKey is WUWOKROJMHWRTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8-11(10(14)4-6-13(8)2)15-9-3-5-12-7-9/h4,6,9,12H,3,5,7H2,1-2H3.
What are the key properties of 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one?
1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one has a molecular weight of 208.26 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-pyrrolidin-3-yloxypyridin-4-one is sourced from PubChem (CID 84676149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).