3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide

C16H14N2O4 — CID 44593609

IUPAC3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide
SMILESNC(=O)c1ccc2occ(CCNC(=O)c3ccco3)c2c1
InChIInChI=1S/C16H14N2O4/c17-15(19)10-3-4-13-12(8-10)11(9-22-13)5-6-18-16(20)14-2-1-7-21-14/h1-4,7-9H,5-6H2,(H2,17,19)(H,18,20)
InChIKeyXSVQVVXJSFYREP-UHFFFAOYSA-N
MW298.30 g/mol
LogP2.10
Rot. Bonds5

About 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide

3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide (PubChem CID 44593609) has the molecular formula C16H14N2O4 and a molecular weight of 298.30 g/mol. Its IUPAC name is 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide.

Molecular Properties

Compound Name3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide
PubChem CID44593609
Molecular FormulaC16H14N2O4
Molecular Weight298.30 g/mol
Exact Mass298.10
IUPAC Name3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide
SMILESNC(=O)c1ccc2occ(CCNC(=O)c3ccco3)c2c1
InChIInChI=1S/C16H14N2O4/c17-15(19)10-3-4-13-12(8-10)11(9-22-13)5-6-18-16(20)14-2-1-7-21-14/h1-4,7-9H,5-6H2,(H2,17,19)(H,18,20)
InChIKeyXSVQVVXJSFYREP-UHFFFAOYSA-N
XLogP2.10
TPSA98.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide 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 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide?
The IUPAC name of 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide (CID 44593609) is 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide.
What is the SMILES notation for 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide?
The canonical SMILES for 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide is NC(=O)c1ccc2occ(CCNC(=O)c3ccco3)c2c1.
What is the InChIKey of 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide?
The InChIKey is XSVQVVXJSFYREP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O4/c17-15(19)10-3-4-13-12(8-10)11(9-22-13)5-6-18-16(20)14-2-1-7-21-14/h1-4,7-9H,5-6H2,(H2,17,19)(H,18,20).
What are the key properties of 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide?
3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide has a molecular weight of 298.30 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-2-carbonylamino)ethyl]-1-benzofuran-5-carboxamide is sourced from PubChem (CID 44593609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).