4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine

C14H20N2O — CID 79879139

IUPAC4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine
SMILESCOc1c(C)cnc(C=C2CCNCC2)c1C
InChIInChI=1S/C14H20N2O/c1-10-9-16-13(11(2)14(10)17-3)8-12-4-6-15-7-5-12/h8-9,15H,4-7H2,1-3H3
InChIKeyCHFBTVUJVFCRDF-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.47
Rot. Bonds2

About 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine

4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine (PubChem CID 79879139) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine.

Molecular Properties

Compound Name4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine
PubChem CID79879139
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine
SMILESCOc1c(C)cnc(C=C2CCNCC2)c1C
InChIInChI=1S/C14H20N2O/c1-10-9-16-13(11(2)14(10)17-3)8-12-4-6-15-7-5-12/h8-9,15H,4-7H2,1-3H3
InChIKeyCHFBTVUJVFCRDF-UHFFFAOYSA-N
XLogP2.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine?
The IUPAC name of 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine (CID 79879139) is 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine.
What is the SMILES notation for 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine?
The canonical SMILES for 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine is COc1c(C)cnc(C=C2CCNCC2)c1C.
What is the InChIKey of 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine?
The InChIKey is CHFBTVUJVFCRDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-9-16-13(11(2)14(10)17-3)8-12-4-6-15-7-5-12/h8-9,15H,4-7H2,1-3H3.
What are the key properties of 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine?
4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine has a molecular weight of 232.33 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3,5-dimethyl-2-(piperidin-4-ylidenemethyl)pyridine is sourced from PubChem (CID 79879139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).