1H-furo[3,4-b]pyrrole

C6H5NO — CID 55288078

IUPAC1H-furo[3,4-b]pyrrole
SMILESc1cc2cocc2[nH]1
InChIInChI=1S/C6H5NO/c1-2-7-6-4-8-3-5(1)6/h1-4,7H
InChIKeyQMRGYLXQIVLGHR-UHFFFAOYSA-N
MW107.11 g/mol
LogP1.76
Rot. Bonds

About 1H-furo[3,4-b]pyrrole

1H-furo[3,4-b]pyrrole (PubChem CID 55288078) has the molecular formula C6H5NO and a molecular weight of 107.11 g/mol. Its IUPAC name is 1H-furo[3,4-b]pyrrole.

Molecular Properties

Compound Name1H-furo[3,4-b]pyrrole
PubChem CID55288078
Molecular FormulaC6H5NO
Molecular Weight107.11 g/mol
Exact Mass107.04
IUPAC Name1H-furo[3,4-b]pyrrole
SMILESc1cc2cocc2[nH]1
InChIInChI=1S/C6H5NO/c1-2-7-6-4-8-3-5(1)6/h1-4,7H
InChIKeyQMRGYLXQIVLGHR-UHFFFAOYSA-N
XLogP1.76
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.11
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1H-furo[3,4-b]pyrrole?
The IUPAC name of 1H-furo[3,4-b]pyrrole (CID 55288078) is 1H-furo[3,4-b]pyrrole.
What is the SMILES notation for 1H-furo[3,4-b]pyrrole?
The canonical SMILES for 1H-furo[3,4-b]pyrrole is c1cc2cocc2[nH]1.
What is the InChIKey of 1H-furo[3,4-b]pyrrole?
The InChIKey is QMRGYLXQIVLGHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NO/c1-2-7-6-4-8-3-5(1)6/h1-4,7H.
What are the key properties of 1H-furo[3,4-b]pyrrole?
1H-furo[3,4-b]pyrrole has a molecular weight of 107.11 g/mol, XLogP of 1.76, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-furo[3,4-b]pyrrole is sourced from PubChem (CID 55288078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).