3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine

C10H17N — CID 126746027

IUPAC3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine
SMILESCCC1=C(C)C=C(C)NC1C
InChIInChI=1S/C10H17N/c1-5-10-7(2)6-8(3)11-9(10)4/h6,9,11H,5H2,1-4H3
InChIKeyQATXVQTUTDBHGF-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.61
Rot. Bonds1

About 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine

3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine (PubChem CID 126746027) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine.

Molecular Properties

Compound Name3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine
PubChem CID126746027
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine
SMILESCCC1=C(C)C=C(C)NC1C
InChIInChI=1S/C10H17N/c1-5-10-7(2)6-8(3)11-9(10)4/h6,9,11H,5H2,1-4H3
InChIKeyQATXVQTUTDBHGF-UHFFFAOYSA-N
XLogP2.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine?
The IUPAC name of 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine (CID 126746027) is 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine.
What is the SMILES notation for 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine?
The canonical SMILES for 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine is CCC1=C(C)C=C(C)NC1C.
What is the InChIKey of 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine?
The InChIKey is QATXVQTUTDBHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-5-10-7(2)6-8(3)11-9(10)4/h6,9,11H,5H2,1-4H3.
What are the key properties of 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine?
3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine has a molecular weight of 151.25 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,4,6-trimethyl-1,2-dihydropyridine is sourced from PubChem (CID 126746027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).