2,3,5,6-tetramethyl-3,4-dihydropyridine

C9H15N — CID 143143584

IUPAC2,3,5,6-tetramethyl-3,4-dihydropyridine
SMILESCC1=NC(C)=C(C)CC1C
InChIInChI=1S/C9H15N/c1-6-5-7(2)9(4)10-8(6)3/h6H,5H2,1-4H3
InChIKeyDVVORQYWQICVSB-UHFFFAOYSA-N
MW137.23 g/mol
LogP2.78
Rot. Bonds

About 2,3,5,6-tetramethyl-3,4-dihydropyridine

2,3,5,6-tetramethyl-3,4-dihydropyridine (PubChem CID 143143584) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 2,3,5,6-tetramethyl-3,4-dihydropyridine.

Molecular Properties

Compound Name2,3,5,6-tetramethyl-3,4-dihydropyridine
PubChem CID143143584
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name2,3,5,6-tetramethyl-3,4-dihydropyridine
SMILESCC1=NC(C)=C(C)CC1C
InChIInChI=1S/C9H15N/c1-6-5-7(2)9(4)10-8(6)3/h6H,5H2,1-4H3
InChIKeyDVVORQYWQICVSB-UHFFFAOYSA-N
XLogP2.78
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetramethyl-3,4-dihydropyridine?
The IUPAC name of 2,3,5,6-tetramethyl-3,4-dihydropyridine (CID 143143584) is 2,3,5,6-tetramethyl-3,4-dihydropyridine.
What is the SMILES notation for 2,3,5,6-tetramethyl-3,4-dihydropyridine?
The canonical SMILES for 2,3,5,6-tetramethyl-3,4-dihydropyridine is CC1=NC(C)=C(C)CC1C.
What is the InChIKey of 2,3,5,6-tetramethyl-3,4-dihydropyridine?
The InChIKey is DVVORQYWQICVSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-6-5-7(2)9(4)10-8(6)3/h6H,5H2,1-4H3.
What are the key properties of 2,3,5,6-tetramethyl-3,4-dihydropyridine?
2,3,5,6-tetramethyl-3,4-dihydropyridine has a molecular weight of 137.23 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetramethyl-3,4-dihydropyridine is sourced from PubChem (CID 143143584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).