ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate

C15H14N2O3 — CID 10492258

IUPACethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2c(oc3ccccc32)c1NC
InChIInChI=1S/C15H14N2O3/c1-3-19-15(18)10-8-17-13-9-6-4-5-7-11(9)20-14(13)12(10)16-2/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyYALRGGHQNVOOJK-UHFFFAOYSA-N
MW270.29 g/mol
LogP3.20
Rot. Bonds3

About ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate

ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate (PubChem CID 10492258) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate
PubChem CID10492258
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Nameethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2c(oc3ccccc32)c1NC
InChIInChI=1S/C15H14N2O3/c1-3-19-15(18)10-8-17-13-9-6-4-5-7-11(9)20-14(13)12(10)16-2/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyYALRGGHQNVOOJK-UHFFFAOYSA-N
XLogP3.20
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate with MolForge

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

Launch Full Analysis

Related Compounds

ethyl 4-(ethylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate
CID 10660706
ethyl 8-cyano-4-(methylamino)quinoline-3-carboxylate
CID 53264523
ethyl 2-(methylamino)-5-oxochromeno[4,3-b]pyridine-3-carboxylate
CID 2754639
ethyl 4-hydrazinyl-8-iodoquinoline-3-carboxylate
CID 62250848
ethyl dibenzofuran-1-carboxylate
CID 11858911
ethyl 4-anilino-8-chloroquinoline-3-carboxylate
CID 728783
ethyl 8-methoxy-6-methyl-4-(methylamino)quinoline-3-carboxylate
CID 54773049
ethyl 8-amino-4-[2-(2-aminophenyl)ethylamino]quinoline-3-carboxylate
CID 10066474
ethyl 8-chloro-4-(2-phenylethylamino)quinoline-3-carboxylate
CID 1181324
ethyl 5,6,8-trifluoro-4-(methylamino)quinoline-3-carboxylate
CID 62809200
ethyl 4-hydrazinyl-8-propan-2-ylquinoline-3-carboxylate
CID 62252346
ethyl 3-[(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate
CID 31806044

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate?
The IUPAC name of ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate (CID 10492258) is ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate?
The canonical SMILES for ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate is CCOC(=O)c1cnc2c(oc3ccccc32)c1NC.
What is the InChIKey of ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate?
The InChIKey is YALRGGHQNVOOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-3-19-15(18)10-8-17-13-9-6-4-5-7-11(9)20-14(13)12(10)16-2/h4-8H,3H2,1-2H3,(H,16,17).
What are the key properties of ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate?
ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate has a molecular weight of 270.29 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(methylamino)-[1]benzofuro[3,2-b]pyridine-3-carboxylate is sourced from PubChem (CID 10492258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).