2,4,5-trimethyl-3,6-dimethylidenepyridine

C10H13N — CID 59775903

IUPAC2,4,5-trimethyl-3,6-dimethylidenepyridine
SMILESC=c1nc(C)c(=C)c(C)c1C
InChIInChI=1S/C10H13N/c1-6-7(2)9(4)11-10(5)8(6)3/h2,5H2,1,3-4H3
InChIKeyZIPBWENXPHLCND-UHFFFAOYSA-N
MW147.22 g/mol
LogP0.83
Rot. Bonds

About 2,4,5-trimethyl-3,6-dimethylidenepyridine

2,4,5-trimethyl-3,6-dimethylidenepyridine (PubChem CID 59775903) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 2,4,5-trimethyl-3,6-dimethylidenepyridine.

Molecular Properties

Compound Name2,4,5-trimethyl-3,6-dimethylidenepyridine
PubChem CID59775903
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name2,4,5-trimethyl-3,6-dimethylidenepyridine
SMILESC=c1nc(C)c(=C)c(C)c1C
InChIInChI=1S/C10H13N/c1-6-7(2)9(4)11-10(5)8(6)3/h2,5H2,1,3-4H3
InChIKeyZIPBWENXPHLCND-UHFFFAOYSA-N
XLogP0.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-3,6-dimethylidenepyridine?
The IUPAC name of 2,4,5-trimethyl-3,6-dimethylidenepyridine (CID 59775903) is 2,4,5-trimethyl-3,6-dimethylidenepyridine.
What is the SMILES notation for 2,4,5-trimethyl-3,6-dimethylidenepyridine?
The canonical SMILES for 2,4,5-trimethyl-3,6-dimethylidenepyridine is C=c1nc(C)c(=C)c(C)c1C.
What is the InChIKey of 2,4,5-trimethyl-3,6-dimethylidenepyridine?
The InChIKey is ZIPBWENXPHLCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-6-7(2)9(4)11-10(5)8(6)3/h2,5H2,1,3-4H3.
What are the key properties of 2,4,5-trimethyl-3,6-dimethylidenepyridine?
2,4,5-trimethyl-3,6-dimethylidenepyridine has a molecular weight of 147.22 g/mol, XLogP of 0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-3,6-dimethylidenepyridine is sourced from PubChem (CID 59775903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).