1-methyl-2-methylidene-3,4-dihydropyridine

C7H11N — CID 67978391

IUPAC1-methyl-2-methylidene-3,4-dihydropyridine
SMILESC=C1CCC=CN1C
InChIInChI=1S/C7H11N/c1-7-5-3-4-6-8(7)2/h4,6H,1,3,5H2,2H3
InChIKeyWCWUHCURZJSPKD-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.74
Rot. Bonds

About 1-methyl-2-methylidene-3,4-dihydropyridine

1-methyl-2-methylidene-3,4-dihydropyridine (PubChem CID 67978391) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 1-methyl-2-methylidene-3,4-dihydropyridine.

Molecular Properties

Compound Name1-methyl-2-methylidene-3,4-dihydropyridine
PubChem CID67978391
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name1-methyl-2-methylidene-3,4-dihydropyridine
SMILESC=C1CCC=CN1C
InChIInChI=1S/C7H11N/c1-7-5-3-4-6-8(7)2/h4,6H,1,3,5H2,2H3
InChIKeyWCWUHCURZJSPKD-UHFFFAOYSA-N
XLogP1.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-methylidene-3,4-dihydropyridine?
The IUPAC name of 1-methyl-2-methylidene-3,4-dihydropyridine (CID 67978391) is 1-methyl-2-methylidene-3,4-dihydropyridine.
What is the SMILES notation for 1-methyl-2-methylidene-3,4-dihydropyridine?
The canonical SMILES for 1-methyl-2-methylidene-3,4-dihydropyridine is C=C1CCC=CN1C.
What is the InChIKey of 1-methyl-2-methylidene-3,4-dihydropyridine?
The InChIKey is WCWUHCURZJSPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-7-5-3-4-6-8(7)2/h4,6H,1,3,5H2,2H3.
What are the key properties of 1-methyl-2-methylidene-3,4-dihydropyridine?
1-methyl-2-methylidene-3,4-dihydropyridine has a molecular weight of 109.17 g/mol, XLogP of 1.74, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-methylidene-3,4-dihydropyridine is sourced from PubChem (CID 67978391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).