furan;pyridine;thiophene

C13H13NOS — CID 19385467

IUPACfuran;pyridine;thiophene
SMILESc1ccncc1.c1ccoc1.c1ccsc1
InChIInChI=1S/C5H5N.C4H4O.C4H4S/c1-2-4-6-5-3-1;2*1-2-4-5-3-1/h1-5H;2*1-4H
InChIKeyAVTBZBRVZYZIDK-UHFFFAOYSA-N
MW231.32 g/mol
LogP4.11
Rot. Bonds

About furan;pyridine;thiophene

furan;pyridine;thiophene (PubChem CID 19385467) has the molecular formula C13H13NOS and a molecular weight of 231.32 g/mol. Its IUPAC name is furan;pyridine;thiophene.

Molecular Properties

Compound Namefuran;pyridine;thiophene
PubChem CID19385467
Molecular FormulaC13H13NOS
Molecular Weight231.32 g/mol
Exact Mass231.07
IUPAC Namefuran;pyridine;thiophene
SMILESc1ccncc1.c1ccoc1.c1ccsc1
InChIInChI=1S/C5H5N.C4H4O.C4H4S/c1-2-4-6-5-3-1;2*1-2-4-5-3-1/h1-5H;2*1-4H
InChIKeyAVTBZBRVZYZIDK-UHFFFAOYSA-N
XLogP4.11
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.32
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan;pyridine;thiophene?
The IUPAC name of furan;pyridine;thiophene (CID 19385467) is furan;pyridine;thiophene.
What is the SMILES notation for furan;pyridine;thiophene?
The canonical SMILES for furan;pyridine;thiophene is c1ccncc1.c1ccoc1.c1ccsc1.
What is the InChIKey of furan;pyridine;thiophene?
The InChIKey is AVTBZBRVZYZIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C4H4O.C4H4S/c1-2-4-6-5-3-1;2*1-2-4-5-3-1/h1-5H;2*1-4H.
What are the key properties of furan;pyridine;thiophene?
furan;pyridine;thiophene has a molecular weight of 231.32 g/mol, XLogP of 4.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan;pyridine;thiophene is sourced from PubChem (CID 19385467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).