furan;pyridine;toluene

C16H17NO — CID 20561534

IUPACfuran;pyridine;toluene
SMILESCc1ccccc1.c1ccncc1.c1ccoc1
InChIInChI=1S/C7H8.C5H5N.C4H4O/c1-7-5-3-2-4-6-7;1-2-4-6-5-3-1;1-2-4-5-3-1/h2-6H,1H3;1-5H;1-4H
InChIKeyXXCODPUBXHINET-UHFFFAOYSA-N
MW239.32 g/mol
LogP4.36
Rot. Bonds

About furan;pyridine;toluene

furan;pyridine;toluene (PubChem CID 20561534) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is furan;pyridine;toluene.

Molecular Properties

Compound Namefuran;pyridine;toluene
PubChem CID20561534
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Namefuran;pyridine;toluene
SMILESCc1ccccc1.c1ccncc1.c1ccoc1
InChIInChI=1S/C7H8.C5H5N.C4H4O/c1-7-5-3-2-4-6-7;1-2-4-6-5-3-1;1-2-4-5-3-1/h2-6H,1H3;1-5H;1-4H
InChIKeyXXCODPUBXHINET-UHFFFAOYSA-N
XLogP4.36
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan;pyridine;toluene?
The IUPAC name of furan;pyridine;toluene (CID 20561534) is furan;pyridine;toluene.
What is the SMILES notation for furan;pyridine;toluene?
The canonical SMILES for furan;pyridine;toluene is Cc1ccccc1.c1ccncc1.c1ccoc1.
What is the InChIKey of furan;pyridine;toluene?
The InChIKey is XXCODPUBXHINET-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.C5H5N.C4H4O/c1-7-5-3-2-4-6-7;1-2-4-6-5-3-1;1-2-4-5-3-1/h2-6H,1H3;1-5H;1-4H.
What are the key properties of furan;pyridine;toluene?
furan;pyridine;toluene has a molecular weight of 239.32 g/mol, XLogP of 4.36, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan;pyridine;toluene is sourced from PubChem (CID 20561534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).