furan;1,2,3,4-tetrahydropyridine

C9H13NO — CID 142861714

IUPACfuran;1,2,3,4-tetrahydropyridine
SMILESC1=CNCCC1.c1ccoc1
InChIInChI=1S/C5H9N.C4H4O/c1-2-4-6-5-3-1;1-2-4-5-3-1/h2,4,6H,1,3,5H2;1-4H
InChIKeyIKOLFMBPWPHPDP-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.16
Rot. Bonds

About furan;1,2,3,4-tetrahydropyridine

furan;1,2,3,4-tetrahydropyridine (PubChem CID 142861714) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is furan;1,2,3,4-tetrahydropyridine.

Molecular Properties

Compound Namefuran;1,2,3,4-tetrahydropyridine
PubChem CID142861714
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Namefuran;1,2,3,4-tetrahydropyridine
SMILESC1=CNCCC1.c1ccoc1
InChIInChI=1S/C5H9N.C4H4O/c1-2-4-6-5-3-1;1-2-4-5-3-1/h2,4,6H,1,3,5H2;1-4H
InChIKeyIKOLFMBPWPHPDP-UHFFFAOYSA-N
XLogP2.16
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan;1,2,3,4-tetrahydropyridine?
The IUPAC name of furan;1,2,3,4-tetrahydropyridine (CID 142861714) is furan;1,2,3,4-tetrahydropyridine.
What is the SMILES notation for furan;1,2,3,4-tetrahydropyridine?
The canonical SMILES for furan;1,2,3,4-tetrahydropyridine is C1=CNCCC1.c1ccoc1.
What is the InChIKey of furan;1,2,3,4-tetrahydropyridine?
The InChIKey is IKOLFMBPWPHPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N.C4H4O/c1-2-4-6-5-3-1;1-2-4-5-3-1/h2,4,6H,1,3,5H2;1-4H.
What are the key properties of furan;1,2,3,4-tetrahydropyridine?
furan;1,2,3,4-tetrahydropyridine has a molecular weight of 151.21 g/mol, XLogP of 2.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan;1,2,3,4-tetrahydropyridine is sourced from PubChem (CID 142861714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).