8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine

C11H17NO — CID 143014048

IUPAC8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine
SMILESCCC1=C(C)NCC2=C1OCCC2
InChIInChI=1S/C11H17NO/c1-3-10-8(2)12-7-9-5-4-6-13-11(9)10/h12H,3-7H2,1-2H3
InChIKeyDPPIZBCJXIKISB-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.34
Rot. Bonds1

About 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine

8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine (PubChem CID 143014048) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine.

Molecular Properties

Compound Name8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine
PubChem CID143014048
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine
SMILESCCC1=C(C)NCC2=C1OCCC2
InChIInChI=1S/C11H17NO/c1-3-10-8(2)12-7-9-5-4-6-13-11(9)10/h12H,3-7H2,1-2H3
InChIKeyDPPIZBCJXIKISB-UHFFFAOYSA-N
XLogP2.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine?
The IUPAC name of 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine (CID 143014048) is 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine.
What is the SMILES notation for 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine?
The canonical SMILES for 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine is CCC1=C(C)NCC2=C1OCCC2.
What is the InChIKey of 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine?
The InChIKey is DPPIZBCJXIKISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-3-10-8(2)12-7-9-5-4-6-13-11(9)10/h12H,3-7H2,1-2H3.
What are the key properties of 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine?
8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine has a molecular weight of 179.26 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-7-methyl-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridine is sourced from PubChem (CID 143014048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).