furan;1H-pyrrole;thiophene

C12H13NOS — CID 18943047

IUPACfuran;1H-pyrrole;thiophene
SMILESc1cc[nH]c1.c1ccoc1.c1ccsc1
InChIInChI=1S/C4H5N.C4H4O.C4H4S/c3*1-2-4-5-3-1/h1-5H;2*1-4H
InChIKeyANHOUBYKJPFVAX-UHFFFAOYSA-N
MW219.31 g/mol
LogP4.04
Rot. Bonds

About furan;1H-pyrrole;thiophene

furan;1H-pyrrole;thiophene (PubChem CID 18943047) has the molecular formula C12H13NOS and a molecular weight of 219.31 g/mol. Its IUPAC name is furan;1H-pyrrole;thiophene.

Molecular Properties

Compound Namefuran;1H-pyrrole;thiophene
PubChem CID18943047
Molecular FormulaC12H13NOS
Molecular Weight219.31 g/mol
Exact Mass219.07
IUPAC Namefuran;1H-pyrrole;thiophene
SMILESc1cc[nH]c1.c1ccoc1.c1ccsc1
InChIInChI=1S/C4H5N.C4H4O.C4H4S/c3*1-2-4-5-3-1/h1-5H;2*1-4H
InChIKeyANHOUBYKJPFVAX-UHFFFAOYSA-N
XLogP4.04
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan;1H-pyrrole;thiophene?
The IUPAC name of furan;1H-pyrrole;thiophene (CID 18943047) is furan;1H-pyrrole;thiophene.
What is the SMILES notation for furan;1H-pyrrole;thiophene?
The canonical SMILES for furan;1H-pyrrole;thiophene is c1cc[nH]c1.c1ccoc1.c1ccsc1.
What is the InChIKey of furan;1H-pyrrole;thiophene?
The InChIKey is ANHOUBYKJPFVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N.C4H4O.C4H4S/c3*1-2-4-5-3-1/h1-5H;2*1-4H.
What are the key properties of furan;1H-pyrrole;thiophene?
furan;1H-pyrrole;thiophene has a molecular weight of 219.31 g/mol, XLogP of 4.04, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan;1H-pyrrole;thiophene is sourced from PubChem (CID 18943047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).