2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine

C11H14N2O — CID 102539328

IUPAC2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
SMILESCOc1ncccc1C1=NCCCC1
InChIInChI=1S/C11H14N2O/c1-14-11-9(5-4-8-13-11)10-6-2-3-7-12-10/h4-5,8H,2-3,6-7H2,1H3
InChIKeyZEBBIXSNNJRBJU-UHFFFAOYSA-N
MW190.25 g/mol
LogP2.06
Rot. Bonds2

About 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine

2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine (PubChem CID 102539328) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine.

Molecular Properties

Compound Name2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
PubChem CID102539328
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
SMILESCOc1ncccc1C1=NCCCC1
InChIInChI=1S/C11H14N2O/c1-14-11-9(5-4-8-13-11)10-6-2-3-7-12-10/h4-5,8H,2-3,6-7H2,1H3
InChIKeyZEBBIXSNNJRBJU-UHFFFAOYSA-N
XLogP2.06
TPSA34.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
The IUPAC name of 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine (CID 102539328) is 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine.
What is the SMILES notation for 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
The canonical SMILES for 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine is COc1ncccc1C1=NCCCC1.
What is the InChIKey of 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
The InChIKey is ZEBBIXSNNJRBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-14-11-9(5-4-8-13-11)10-6-2-3-7-12-10/h4-5,8H,2-3,6-7H2,1H3.
What are the key properties of 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine?
2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine has a molecular weight of 190.25 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine is sourced from PubChem (CID 102539328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).