1-methyl-3-pyrrolidin-3-yloxypyridin-4-one

C10H14N2O2 — CID 84665470

IUPAC1-methyl-3-pyrrolidin-3-yloxypyridin-4-one
SMILESCn1ccc(=O)c(OC2CCNC2)c1
InChIInChI=1S/C10H14N2O2/c1-12-5-3-9(13)10(7-12)14-8-2-4-11-6-8/h3,5,7-8,11H,2,4,6H2,1H3
InChIKeyFCSCQTJSBSYWAS-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.13
Rot. Bonds2

About 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one

1-methyl-3-pyrrolidin-3-yloxypyridin-4-one (PubChem CID 84665470) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one.

Molecular Properties

Compound Name1-methyl-3-pyrrolidin-3-yloxypyridin-4-one
PubChem CID84665470
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name1-methyl-3-pyrrolidin-3-yloxypyridin-4-one
SMILESCn1ccc(=O)c(OC2CCNC2)c1
InChIInChI=1S/C10H14N2O2/c1-12-5-3-9(13)10(7-12)14-8-2-4-11-6-8/h3,5,7-8,11H,2,4,6H2,1H3
InChIKeyFCSCQTJSBSYWAS-UHFFFAOYSA-N
XLogP0.13
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one?
The IUPAC name of 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one (CID 84665470) is 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one.
What is the SMILES notation for 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one?
The canonical SMILES for 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one is Cn1ccc(=O)c(OC2CCNC2)c1.
What is the InChIKey of 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one?
The InChIKey is FCSCQTJSBSYWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-12-5-3-9(13)10(7-12)14-8-2-4-11-6-8/h3,5,7-8,11H,2,4,6H2,1H3.
What are the key properties of 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one?
1-methyl-3-pyrrolidin-3-yloxypyridin-4-one has a molecular weight of 194.23 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-pyrrolidin-3-yloxypyridin-4-one is sourced from PubChem (CID 84665470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).