4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide

C15H17NO4 — CID 1079830

IUPAC4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide
SMILESCCOc1ccc(C(=O)NCc2ccco2)cc1OC
InChIInChI=1S/C15H17NO4/c1-3-19-13-7-6-11(9-14(13)18-2)15(17)16-10-12-5-4-8-20-12/h4-9H,3,10H2,1-2H3,(H,16,17)
InChIKeyGIGJMJXEOGBVQB-UHFFFAOYSA-N
MW275.30 g/mol
LogP2.62
Rot. Bonds6

About 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide

4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide (PubChem CID 1079830) has the molecular formula C15H17NO4 and a molecular weight of 275.30 g/mol. Its IUPAC name is 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide.

Molecular Properties

Compound Name4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide
PubChem CID1079830
Molecular FormulaC15H17NO4
Molecular Weight275.30 g/mol
Exact Mass275.12
IUPAC Name4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide
SMILESCCOc1ccc(C(=O)NCc2ccco2)cc1OC
InChIInChI=1S/C15H17NO4/c1-3-19-13-7-6-11(9-14(13)18-2)15(17)16-10-12-5-4-8-20-12/h4-9H,3,10H2,1-2H3,(H,16,17)
InChIKeyGIGJMJXEOGBVQB-UHFFFAOYSA-N
XLogP2.62
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide?
The IUPAC name of 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide (CID 1079830) is 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide.
What is the SMILES notation for 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide?
The canonical SMILES for 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide is CCOc1ccc(C(=O)NCc2ccco2)cc1OC.
What is the InChIKey of 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide?
The InChIKey is GIGJMJXEOGBVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4/c1-3-19-13-7-6-11(9-14(13)18-2)15(17)16-10-12-5-4-8-20-12/h4-9H,3,10H2,1-2H3,(H,16,17).
What are the key properties of 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide?
4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide has a molecular weight of 275.30 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(furan-2-ylmethyl)-3-methoxybenzamide is sourced from PubChem (CID 1079830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).