ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate

C11H13NO3 — CID 1438679

IUPACethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate
SMILESCCOC(=O)c1cc2occc2n1CC
InChIInChI=1S/C11H13NO3/c1-3-12-8-5-6-15-10(8)7-9(12)11(13)14-4-2/h5-7H,3-4H2,1-2H3
InChIKeyDLPAMSXQFJAVEY-UHFFFAOYSA-N
MW207.23 g/mol
LogP2.43
Rot. Bonds3

About ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate

ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate (PubChem CID 1438679) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate.

Molecular Properties

Compound Nameethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate
PubChem CID1438679
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Nameethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate
SMILESCCOC(=O)c1cc2occc2n1CC
InChIInChI=1S/C11H13NO3/c1-3-12-8-5-6-15-10(8)7-9(12)11(13)14-4-2/h5-7H,3-4H2,1-2H3
InChIKeyDLPAMSXQFJAVEY-UHFFFAOYSA-N
XLogP2.43
TPSA44.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate?
The IUPAC name of ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate (CID 1438679) is ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate.
What is the SMILES notation for ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate?
The canonical SMILES for ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate is CCOC(=O)c1cc2occc2n1CC.
What is the InChIKey of ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate?
The InChIKey is DLPAMSXQFJAVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-3-12-8-5-6-15-10(8)7-9(12)11(13)14-4-2/h5-7H,3-4H2,1-2H3.
What are the key properties of ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate?
ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate has a molecular weight of 207.23 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-ethylfuro[3,2-b]pyrrole-5-carboxylate is sourced from PubChem (CID 1438679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).