6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine

C10H19N — CID 118357205

IUPAC6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
SMILESCCC1C=C(C(C)C)CCN1
InChIInChI=1S/C10H19N/c1-4-10-7-9(8(2)3)5-6-11-10/h7-8,10-11H,4-6H2,1-3H3
InChIKeyCUEWSMPJJPTRAY-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.34
Rot. Bonds2

About 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine

6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine (PubChem CID 118357205) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine.

Molecular Properties

Compound Name6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
PubChem CID118357205
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine
SMILESCCC1C=C(C(C)C)CCN1
InChIInChI=1S/C10H19N/c1-4-10-7-9(8(2)3)5-6-11-10/h7-8,10-11H,4-6H2,1-3H3
InChIKeyCUEWSMPJJPTRAY-UHFFFAOYSA-N
XLogP2.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Isometheptene
CID 22297
Dexisometheptene
CID 24871315
(2S,6S)-2,6-diallyl-4-methyl-1,2,3,6-tetrahydropyridinium
CID 16193239
(3,7,11-Trimethyl-dodeca-2,6,10-trienyl)-(2,6,10-trimethyl-undeca-5,9-dienyl)-amine
CID 10431909
2,6-Diallyl-4-methyl-1,2,3,6-tetrahydropyridine
CID 2859356
Isometheptene-mucate
CID 6604597
1-(Cyclohexa-1,4-dien-1-yl)-N-methylpropan-2-amine
CID 57487843
(2S,6S)-2,6-Diallyl-4-methyl-1,2,3,6-tetrahydropyridine
CID 2063692
6-Methyl-N-(prop-2-en-1-yl)hept-5-en-2-amine
CID 20850
4-Hexenylamine, N,1,2,5-tetramethyl-
CID 49627
Ethylamine, N-allyl-2-(2-cyclopentenyl)-1-methyl-
CID 49661
1-(1-Methyl-1,2,3,6-tetrahydropyridin-4-yl)ethan-1-amine
CID 71758631

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The IUPAC name of 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine (CID 118357205) is 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine.
What is the SMILES notation for 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The canonical SMILES for 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine is CCC1C=C(C(C)C)CCN1.
What is the InChIKey of 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
The InChIKey is CUEWSMPJJPTRAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-4-10-7-9(8(2)3)5-6-11-10/h7-8,10-11H,4-6H2,1-3H3.
What are the key properties of 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine?
6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine has a molecular weight of 153.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine is sourced from PubChem (CID 118357205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).