1-methyl-4-methylidenepyridine

C7H9N — CID 23534281

IUPAC1-methyl-4-methylidenepyridine
SMILESC=C1C=CN(C)C=C1
InChIInChI=1S/C7H9N/c1-7-3-5-8(2)6-4-7/h3-6H,1H2,2H3
InChIKeyDWEGQVCLBTXPSB-UHFFFAOYSA-N
MW107.16 g/mol
LogP1.52
Rot. Bonds

About 1-methyl-4-methylidenepyridine

1-methyl-4-methylidenepyridine (PubChem CID 23534281) has the molecular formula C7H9N and a molecular weight of 107.16 g/mol. Its IUPAC name is 1-methyl-4-methylidenepyridine.

Molecular Properties

Compound Name1-methyl-4-methylidenepyridine
PubChem CID23534281
Molecular FormulaC7H9N
Molecular Weight107.16 g/mol
Exact Mass107.07
IUPAC Name1-methyl-4-methylidenepyridine
SMILESC=C1C=CN(C)C=C1
InChIInChI=1S/C7H9N/c1-7-3-5-8(2)6-4-7/h3-6H,1H2,2H3
InChIKeyDWEGQVCLBTXPSB-UHFFFAOYSA-N
XLogP1.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.16
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-methylidenepyridine?
The IUPAC name of 1-methyl-4-methylidenepyridine (CID 23534281) is 1-methyl-4-methylidenepyridine.
What is the SMILES notation for 1-methyl-4-methylidenepyridine?
The canonical SMILES for 1-methyl-4-methylidenepyridine is C=C1C=CN(C)C=C1.
What is the InChIKey of 1-methyl-4-methylidenepyridine?
The InChIKey is DWEGQVCLBTXPSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N/c1-7-3-5-8(2)6-4-7/h3-6H,1H2,2H3.
What are the key properties of 1-methyl-4-methylidenepyridine?
1-methyl-4-methylidenepyridine has a molecular weight of 107.16 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-methylidenepyridine is sourced from PubChem (CID 23534281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).