6-(furan-2-yl)-2,3,4,5-tetrahydropyridine

C9H11NO — CID 91748327

IUPAC6-(furan-2-yl)-2,3,4,5-tetrahydropyridine
SMILESc1coc(C2=NCCCC2)c1
InChIInChI=1S/C9H11NO/c1-2-6-10-8(4-1)9-5-3-7-11-9/h3,5,7H,1-2,4,6H2
InChIKeyRGIWMFASVSUDLJ-UHFFFAOYSA-N
MW149.19 g/mol
LogP2.25
Rot. Bonds1

About 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine

6-(furan-2-yl)-2,3,4,5-tetrahydropyridine (PubChem CID 91748327) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name6-(furan-2-yl)-2,3,4,5-tetrahydropyridine
PubChem CID91748327
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name6-(furan-2-yl)-2,3,4,5-tetrahydropyridine
SMILESc1coc(C2=NCCCC2)c1
InChIInChI=1S/C9H11NO/c1-2-6-10-8(4-1)9-5-3-7-11-9/h3,5,7H,1-2,4,6H2
InChIKeyRGIWMFASVSUDLJ-UHFFFAOYSA-N
XLogP2.25
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine?
The IUPAC name of 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine (CID 91748327) is 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine is c1coc(C2=NCCCC2)c1.
What is the InChIKey of 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine?
The InChIKey is RGIWMFASVSUDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-2-6-10-8(4-1)9-5-3-7-11-9/h3,5,7H,1-2,4,6H2.
What are the key properties of 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine?
6-(furan-2-yl)-2,3,4,5-tetrahydropyridine has a molecular weight of 149.19 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 91748327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).