1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine

C9H17N — CID 20692709

IUPAC1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine
SMILESCC1=CC(C)N(C)C(C)C1
InChIInChI=1S/C9H17N/c1-7-5-8(2)10(4)9(3)6-7/h5,8-9H,6H2,1-4H3
InChIKeyLODXWYOJJHPZQF-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.05
Rot. Bonds

About 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine

1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine (PubChem CID 20692709) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine
PubChem CID20692709
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine
SMILESCC1=CC(C)N(C)C(C)C1
InChIInChI=1S/C9H17N/c1-7-5-8(2)10(4)9(3)6-7/h5,8-9H,6H2,1-4H3
InChIKeyLODXWYOJJHPZQF-UHFFFAOYSA-N
XLogP2.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.05
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

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3,9-dimethyl-9-azabicyclo[3.3.1]non-2-ene
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1-(3,5-dimethylcyclohex-3-en-1-yl)-2,2-dimethylpropan-1-ol
CID 103277645
N-[(3,5-dimethylcyclohex-3-en-1-yl)methyl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 103276855
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Frequently Asked Questions

What is the IUPAC name of 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine (CID 20692709) is 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine is CC1=CC(C)N(C)C(C)C1.
What is the InChIKey of 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine?
The InChIKey is LODXWYOJJHPZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-7-5-8(2)10(4)9(3)6-7/h5,8-9H,6H2,1-4H3.
What are the key properties of 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine?
1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine has a molecular weight of 139.24 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4,6-tetramethyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 20692709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).