3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine

C13H19NO — CID 144782722

IUPAC3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine
SMILESC=C1C(OC)=CC=CN1/C(C)=C(\C)CC
InChIInChI=1S/C13H19NO/c1-6-10(2)11(3)14-9-7-8-13(15-5)12(14)4/h7-9H,4,6H2,1-3,5H3/b11-10+
InChIKeyYLUJVYDHWMGUCC-ZHACJKMWSA-N
MW205.30 g/mol
LogP3.56
Rot. Bonds3

About 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine

3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine (PubChem CID 144782722) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine.

Molecular Properties

Compound Name3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine
PubChem CID144782722
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine
SMILESC=C1C(OC)=CC=CN1/C(C)=C(\C)CC
InChIInChI=1S/C13H19NO/c1-6-10(2)11(3)14-9-7-8-13(15-5)12(14)4/h7-9H,4,6H2,1-3,5H3/b11-10+
InChIKeyYLUJVYDHWMGUCC-ZHACJKMWSA-N
XLogP3.56
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
The IUPAC name of 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine (CID 144782722) is 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine.
What is the SMILES notation for 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
The canonical SMILES for 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine is C=C1C(OC)=CC=CN1/C(C)=C(\C)CC.
What is the InChIKey of 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
The InChIKey is YLUJVYDHWMGUCC-ZHACJKMWSA-N. The full InChI is InChI=1S/C13H19NO/c1-6-10(2)11(3)14-9-7-8-13(15-5)12(14)4/h7-9H,4,6H2,1-3,5H3/b11-10+.
What are the key properties of 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine has a molecular weight of 205.30 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methylidene-1-[(E)-3-methylpent-2-en-2-yl]pyridine is sourced from PubChem (CID 144782722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).