2-ethoxy-3-propoxy-1,2-dihydropyridine

C10H17NO2 — CID 173058117

IUPAC2-ethoxy-3-propoxy-1,2-dihydropyridine
SMILESCCCOC1=CC=CNC1OCC
InChIInChI=1S/C10H17NO2/c1-3-8-13-9-6-5-7-11-10(9)12-4-2/h5-7,10-11H,3-4,8H2,1-2H3
InChIKeyQRNHTOSCKYKZKA-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.78
Rot. Bonds5

About 2-ethoxy-3-propoxy-1,2-dihydropyridine

2-ethoxy-3-propoxy-1,2-dihydropyridine (PubChem CID 173058117) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-ethoxy-3-propoxy-1,2-dihydropyridine.

Molecular Properties

Compound Name2-ethoxy-3-propoxy-1,2-dihydropyridine
PubChem CID173058117
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name2-ethoxy-3-propoxy-1,2-dihydropyridine
SMILESCCCOC1=CC=CNC1OCC
InChIInChI=1S/C10H17NO2/c1-3-8-13-9-6-5-7-11-10(9)12-4-2/h5-7,10-11H,3-4,8H2,1-2H3
InChIKeyQRNHTOSCKYKZKA-UHFFFAOYSA-N
XLogP1.78
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-Dimethoxy-1,2-dihydropyridine
CID 18619796
(2S)-2-(2-methoxyethoxy)-1,2-dihydropyridine
CID 68320761
2-(2-Methoxyethoxy)-1,2-dihydropyridine
CID 77478651
2,3-diethoxy-2H-pyridin-1-amine
CID 141075559
3,8-Dimethoxy-2,3,4,8a-tetrahydro-[1,3]oxazolo[3,2-a]pyridin-4-ium;ethane;sulfane
CID 142287652
(5Z,7Z)-3-methoxy-2,3,4,9-tetrahydro-1,4-oxazonin-4-ium
CID 142287659
(2-Methoxy-3-propan-2-yloxy-1,2-dihydropyridin-6-yl)phosphane
CID 145573204
(3E)-N-ethenyl-3-ethylidene-1,4-dioxan-2-amine;(3Z)-penta-1,3-diene
CID 145633493
3-Ethoxy-2-methoxy-1,2-dihydropyridine
CID 173058050
2-Methoxy-3-propoxy-1,2-dihydropyridine
CID 173058141
2,3-Diethoxy-1,2-dihydropyridine
CID 173058163
2,3,5,6-Tetrahydro-[1,4]dioxino[2,3-c]pyridine
CID 173084042

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-propoxy-1,2-dihydropyridine?
The IUPAC name of 2-ethoxy-3-propoxy-1,2-dihydropyridine (CID 173058117) is 2-ethoxy-3-propoxy-1,2-dihydropyridine.
What is the SMILES notation for 2-ethoxy-3-propoxy-1,2-dihydropyridine?
The canonical SMILES for 2-ethoxy-3-propoxy-1,2-dihydropyridine is CCCOC1=CC=CNC1OCC.
What is the InChIKey of 2-ethoxy-3-propoxy-1,2-dihydropyridine?
The InChIKey is QRNHTOSCKYKZKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-8-13-9-6-5-7-11-10(9)12-4-2/h5-7,10-11H,3-4,8H2,1-2H3.
What are the key properties of 2-ethoxy-3-propoxy-1,2-dihydropyridine?
2-ethoxy-3-propoxy-1,2-dihydropyridine has a molecular weight of 183.25 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-propoxy-1,2-dihydropyridine is sourced from PubChem (CID 173058117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).