N-(2,4-dimethoxyphenyl)furan-2-carboxamide

C13H13NO4 — CID 565184

IUPACN-(2,4-dimethoxyphenyl)furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccco2)c(OC)c1
InChIInChI=1S/C13H13NO4/c1-16-9-5-6-10(12(8-9)17-2)14-13(15)11-4-3-7-18-11/h3-8H,1-2H3,(H,14,15)
InChIKeyYWAQGIJFAUWHBN-UHFFFAOYSA-N
MW247.25 g/mol
LogP2.55
Rot. Bonds4

About N-(2,4-dimethoxyphenyl)furan-2-carboxamide

N-(2,4-dimethoxyphenyl)furan-2-carboxamide (PubChem CID 565184) has the molecular formula C13H13NO4 and a molecular weight of 247.25 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)furan-2-carboxamide
PubChem CID565184
Molecular FormulaC13H13NO4
Molecular Weight247.25 g/mol
Exact Mass247.08
IUPAC NameN-(2,4-dimethoxyphenyl)furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccco2)c(OC)c1
InChIInChI=1S/C13H13NO4/c1-16-9-5-6-10(12(8-9)17-2)14-13(15)11-4-3-7-18-11/h3-8H,1-2H3,(H,14,15)
InChIKeyYWAQGIJFAUWHBN-UHFFFAOYSA-N
XLogP2.55
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)furan-2-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)furan-2-carboxamide (CID 565184) is N-(2,4-dimethoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)furan-2-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)furan-2-carboxamide is COc1ccc(NC(=O)c2ccco2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)furan-2-carboxamide?
The InChIKey is YWAQGIJFAUWHBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO4/c1-16-9-5-6-10(12(8-9)17-2)14-13(15)11-4-3-7-18-11/h3-8H,1-2H3,(H,14,15).
What are the key properties of N-(2,4-dimethoxyphenyl)furan-2-carboxamide?
N-(2,4-dimethoxyphenyl)furan-2-carboxamide has a molecular weight of 247.25 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 565184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).