ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate

C18H15NO3 — CID 162519628

IUPACethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate
SMILESC=Cc1cc2occc2c(-c2ccc(C(=O)OCC)cc2)n1
InChIInChI=1S/C18H15NO3/c1-3-14-11-16-15(9-10-22-16)17(19-14)12-5-7-13(8-6-12)18(20)21-4-2/h3,5-11H,1,4H2,2H3
InChIKeyQAIKSFJZVCVCKP-UHFFFAOYSA-N
MW293.32 g/mol
LogP4.31
Rot. Bonds4

About ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate

ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate (PubChem CID 162519628) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate.

Molecular Properties

Compound Nameethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate
PubChem CID162519628
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Nameethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate
SMILESC=Cc1cc2occc2c(-c2ccc(C(=O)OCC)cc2)n1
InChIInChI=1S/C18H15NO3/c1-3-14-11-16-15(9-10-22-16)17(19-14)12-5-7-13(8-6-12)18(20)21-4-2/h3,5-11H,1,4H2,2H3
InChIKeyQAIKSFJZVCVCKP-UHFFFAOYSA-N
XLogP4.31
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate?
The IUPAC name of ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate (CID 162519628) is ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate.
What is the SMILES notation for ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate?
The canonical SMILES for ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate is C=Cc1cc2occc2c(-c2ccc(C(=O)OCC)cc2)n1.
What is the InChIKey of ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate?
The InChIKey is QAIKSFJZVCVCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-3-14-11-16-15(9-10-22-16)17(19-14)12-5-7-13(8-6-12)18(20)21-4-2/h3,5-11H,1,4H2,2H3.
What are the key properties of ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate?
ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate has a molecular weight of 293.32 g/mol, XLogP of 4.31, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(6-ethenylfuro[3,2-c]pyridin-4-yl)benzoate is sourced from PubChem (CID 162519628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).