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

C11H13N — CID 11829725

IUPAC6-phenyl-2,3,4,5-tetrahydropyridine
SMILESc1ccc(C2=NCCCC2)cc1
InChIInChI=1S/C11H13N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7H,4-5,8-9H2
InChIKeyXEJFZEYFXUTFPM-UHFFFAOYSA-N
MW159.23 g/mol
LogP2.66
Rot. Bonds1

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

6-phenyl-2,3,4,5-tetrahydropyridine (PubChem CID 11829725) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is 6-phenyl-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name6-phenyl-2,3,4,5-tetrahydropyridine
PubChem CID11829725
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name6-phenyl-2,3,4,5-tetrahydropyridine
SMILESc1ccc(C2=NCCCC2)cc1
InChIInChI=1S/C11H13N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7H,4-5,8-9H2
InChIKeyXEJFZEYFXUTFPM-UHFFFAOYSA-N
XLogP2.66
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-phenyl-2,3,4,5-tetrahydropyridine?
The IUPAC name of 6-phenyl-2,3,4,5-tetrahydropyridine (CID 11829725) is 6-phenyl-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 6-phenyl-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 6-phenyl-2,3,4,5-tetrahydropyridine is c1ccc(C2=NCCCC2)cc1.
What is the InChIKey of 6-phenyl-2,3,4,5-tetrahydropyridine?
The InChIKey is XEJFZEYFXUTFPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7H,4-5,8-9H2.
What are the key properties of 6-phenyl-2,3,4,5-tetrahydropyridine?
6-phenyl-2,3,4,5-tetrahydropyridine has a molecular weight of 159.23 g/mol, XLogP of 2.66, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 11829725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).