3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine

C13H25N — CID 22154996

IUPAC3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine
SMILESCCC1=NCC(CC)C(CC)C1CC
InChIInChI=1S/C13H25N/c1-5-10-9-14-13(8-4)12(7-3)11(10)6-2/h10-12H,5-9H2,1-4H3
InChIKeyMKGQJCMYGGJDAY-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.93
Rot. Bonds4

About 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine

3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine (PubChem CID 22154996) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine
PubChem CID22154996
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine
SMILESCCC1=NCC(CC)C(CC)C1CC
InChIInChI=1S/C13H25N/c1-5-10-9-14-13(8-4)12(7-3)11(10)6-2/h10-12H,5-9H2,1-4H3
InChIKeyMKGQJCMYGGJDAY-UHFFFAOYSA-N
XLogP3.93
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-tert-Butyl-2,3,4,5-tetrahydropyridine
CID 546050
6-Cyclohexyl-2,3,4,5-tetrahydropyridine
CID 12229454
6-(Propan-2-yl)-2,3,4,5-tetrahydropyridine
CID 22956980
2-Cyclohexyl-1-pyrroline
CID 53832044
6-ethyl-3,3-dimethyl-4,5-dihydro-2H-pyridine
CID 91327757
1-Methyl-2-azaspiro[4.5]dec-1-ene
CID 101961579
6-Butan-2-yl-2,3,4,5-tetrahydropyridine
CID 134926218
(2S)-5-fluoro-2,9-dimethyl-4-propyl-3,4,5,6,7,8-hexahydro-2H-azonine
CID 138749750
5-fluoro-2,3-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indole
CID 144302912
5-Fluoro-6-propan-2-yl-2,3,4,5-tetrahydropyridine
CID 172343921
3,5-Difluoro-6-(3-methylbutan-2-yl)-2,3,4,5-tetrahydropyridine
CID 172345489
1-cyclohexyl-N-propylethanimine
CID 11095012

Frequently Asked Questions

What is the IUPAC name of 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine?
The IUPAC name of 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine (CID 22154996) is 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine is CCC1=NCC(CC)C(CC)C1CC.
What is the InChIKey of 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine?
The InChIKey is MKGQJCMYGGJDAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-5-10-9-14-13(8-4)12(7-3)11(10)6-2/h10-12H,5-9H2,1-4H3.
What are the key properties of 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine?
3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine has a molecular weight of 195.35 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,6-tetraethyl-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 22154996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).