3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine

C10H16N2 — CID 134174563

IUPAC3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine
SMILESC1=CNCC(C2C=NCCC2)C1
InChIInChI=1S/C10H16N2/c1-3-9(7-11-5-1)10-4-2-6-12-8-10/h1,5,8-11H,2-4,6-7H2
InChIKeyYQBLYQNEXQZIJW-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.59
Rot. Bonds1

About 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine

3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine (PubChem CID 134174563) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine.

Molecular Properties

Compound Name3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine
PubChem CID134174563
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine
SMILESC1=CNCC(C2C=NCCC2)C1
InChIInChI=1S/C10H16N2/c1-3-9(7-11-5-1)10-4-2-6-12-8-10/h1,5,8-11H,2-4,6-7H2
InChIKeyYQBLYQNEXQZIJW-UHFFFAOYSA-N
XLogP1.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine?
The IUPAC name of 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine (CID 134174563) is 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine.
What is the SMILES notation for 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine?
The canonical SMILES for 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine is C1=CNCC(C2C=NCCC2)C1.
What is the InChIKey of 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine?
The InChIKey is YQBLYQNEXQZIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-9(7-11-5-1)10-4-2-6-12-8-10/h1,5,8-11H,2-4,6-7H2.
What are the key properties of 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine?
3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine has a molecular weight of 164.25 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3,4,5-tetrahydropyridin-5-yl)-1,2,3,4-tetrahydropyridine is sourced from PubChem (CID 134174563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).