3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one

C10H14N2O2 — CID 84665472

IUPAC3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one
SMILESNCCOc1cn(C2CC2)ccc1=O
InChIInChI=1S/C10H14N2O2/c11-4-6-14-10-7-12(8-1-2-8)5-3-9(10)13/h3,5,7-8H,1-2,4,6,11H2
InChIKeyLUDPBBDBJHRORC-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.52
Rot. Bonds4

About 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one

3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one (PubChem CID 84665472) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one.

Molecular Properties

Compound Name3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one
PubChem CID84665472
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one
SMILESNCCOc1cn(C2CC2)ccc1=O
InChIInChI=1S/C10H14N2O2/c11-4-6-14-10-7-12(8-1-2-8)5-3-9(10)13/h3,5,7-8H,1-2,4,6,11H2
InChIKeyLUDPBBDBJHRORC-UHFFFAOYSA-N
XLogP0.52
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one?
The IUPAC name of 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one (CID 84665472) is 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one.
What is the SMILES notation for 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one?
The canonical SMILES for 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one is NCCOc1cn(C2CC2)ccc1=O.
What is the InChIKey of 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one?
The InChIKey is LUDPBBDBJHRORC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c11-4-6-14-10-7-12(8-1-2-8)5-3-9(10)13/h3,5,7-8H,1-2,4,6,11H2.
What are the key properties of 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one?
3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one has a molecular weight of 194.23 g/mol, XLogP of 0.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethoxy)-1-cyclopropylpyridin-4-one is sourced from PubChem (CID 84665472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).