5-ethenyl-1,2,3,4-tetrahydropyridine

C7H11N — CID 21110357

IUPAC5-ethenyl-1,2,3,4-tetrahydropyridine
SMILESC=CC1=CNCCC1
InChIInChI=1S/C7H11N/c1-2-7-4-3-5-8-6-7/h2,6,8H,1,3-5H2
InChIKeyZGRBLBJJWDRUNA-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.44
Rot. Bonds1

About 5-ethenyl-1,2,3,4-tetrahydropyridine

5-ethenyl-1,2,3,4-tetrahydropyridine (PubChem CID 21110357) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 5-ethenyl-1,2,3,4-tetrahydropyridine.

Molecular Properties

Compound Name5-ethenyl-1,2,3,4-tetrahydropyridine
PubChem CID21110357
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name5-ethenyl-1,2,3,4-tetrahydropyridine
SMILESC=CC1=CNCCC1
InChIInChI=1S/C7H11N/c1-2-7-4-3-5-8-6-7/h2,6,8H,1,3-5H2
InChIKeyZGRBLBJJWDRUNA-UHFFFAOYSA-N
XLogP1.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1,2,3,4-tetrahydropyridine?
The IUPAC name of 5-ethenyl-1,2,3,4-tetrahydropyridine (CID 21110357) is 5-ethenyl-1,2,3,4-tetrahydropyridine.
What is the SMILES notation for 5-ethenyl-1,2,3,4-tetrahydropyridine?
The canonical SMILES for 5-ethenyl-1,2,3,4-tetrahydropyridine is C=CC1=CNCCC1.
What is the InChIKey of 5-ethenyl-1,2,3,4-tetrahydropyridine?
The InChIKey is ZGRBLBJJWDRUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-2-7-4-3-5-8-6-7/h2,6,8H,1,3-5H2.
What are the key properties of 5-ethenyl-1,2,3,4-tetrahydropyridine?
5-ethenyl-1,2,3,4-tetrahydropyridine has a molecular weight of 109.17 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1,2,3,4-tetrahydropyridine is sourced from PubChem (CID 21110357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).