6-methyl-3-methylidene-4,5-dihydro-2H-pyridine

C7H11N — CID 91101587

IUPAC6-methyl-3-methylidene-4,5-dihydro-2H-pyridine
SMILESC=C1CCC(C)=NC1
InChIInChI=1S/C7H11N/c1-6-3-4-7(2)8-5-6/h1,3-5H2,2H3
InChIKeyQUEBVPXBSIJRJN-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.80
Rot. Bonds

About 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine

6-methyl-3-methylidene-4,5-dihydro-2H-pyridine (PubChem CID 91101587) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine.

Molecular Properties

Compound Name6-methyl-3-methylidene-4,5-dihydro-2H-pyridine
PubChem CID91101587
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name6-methyl-3-methylidene-4,5-dihydro-2H-pyridine
SMILESC=C1CCC(C)=NC1
InChIInChI=1S/C7H11N/c1-6-3-4-7(2)8-5-6/h1,3-5H2,2H3
InChIKeyQUEBVPXBSIJRJN-UHFFFAOYSA-N
XLogP1.80
TPSA12.36 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 ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-Prop-1-en-2-yl-2,3,4,5-tetrahydropyridine
CID 135085650
5-(3-methylbut-3-enyl)-3,4-dihydro-2H-pyrrole
CID 21677162
2,5-Dimethyl-3-methylidene-2,4-dihydropyrrole
CID 20663941
5-prop-1-en-2-yl-3,4-dihydro-2H-pyrrole
CID 21137936
3-Butyl-6-methyl-2,5-dihydropyridine
CID 57086307
5-Methyl-3-methylidene-2,4-dihydropyrrole
CID 59659995
2,5-Dimethyl-3,4-dihydropyridine
CID 68215781
1,6-dimethyl-3,5-dimethylidene-2H-pyridin-1-ium chloride
CID 69527425
5-methyl-2-prop-1-en-2-yl-3,4-dihydro-2H-pyrrole
CID 102498818
6-methyl-4-methylidene-3,5-dihydro-2H-pyridine
CID 123247329
6-methyl-5-methylidene-3,4-dihydro-2H-pyridine
CID 123542747
N-(3-methylideneoctyl)pentan-2-imine
CID 123823378

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine?
The IUPAC name of 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine (CID 91101587) is 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine.
What is the SMILES notation for 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine?
The canonical SMILES for 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine is C=C1CCC(C)=NC1.
What is the InChIKey of 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine?
The InChIKey is QUEBVPXBSIJRJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-6-3-4-7(2)8-5-6/h1,3-5H2,2H3.
What are the key properties of 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine?
6-methyl-3-methylidene-4,5-dihydro-2H-pyridine has a molecular weight of 109.17 g/mol, XLogP of 1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-methylidene-4,5-dihydro-2H-pyridine is sourced from PubChem (CID 91101587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).