5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid

C11H15NO5 — CID 104607286

IUPAC5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid
SMILESCCN(CCOC)C(=O)c1cc(C(=O)O)co1
InChIInChI=1S/C11H15NO5/c1-3-12(4-5-16-2)10(13)9-6-8(7-17-9)11(14)15/h6-7H,3-5H2,1-2H3,(H,14,15)
InChIKeyWUHQAXYQHJMPED-UHFFFAOYSA-N
MW241.24 g/mol
LogP1.09
Rot. Bonds6

About 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid

5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid (PubChem CID 104607286) has the molecular formula C11H15NO5 and a molecular weight of 241.24 g/mol. Its IUPAC name is 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid.

Molecular Properties

Compound Name5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid
PubChem CID104607286
Molecular FormulaC11H15NO5
Molecular Weight241.24 g/mol
Exact Mass241.10
IUPAC Name5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid
SMILESCCN(CCOC)C(=O)c1cc(C(=O)O)co1
InChIInChI=1S/C11H15NO5/c1-3-12(4-5-16-2)10(13)9-6-8(7-17-9)11(14)15/h6-7H,3-5H2,1-2H3,(H,14,15)
InChIKeyWUHQAXYQHJMPED-UHFFFAOYSA-N
XLogP1.09
TPSA79.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.24
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[bis(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid
CID 113432257
5-[ethyl(2-methylpropyl)carbamoyl]furan-3-carboxylic acid
CID 104607143
5-[1-methoxypropan-2-yl(methyl)carbamoyl]furan-3-carboxylic acid
CID 104607291
5-[2-hydroxyethyl(methyl)carbamoyl]furan-3-carboxylic acid
CID 104607214
3-[2-[[ethyl(2-methoxyethyl)carbamoyl]amino]ethyl]benzoic acid
CID 63793879
5-[ethyl-(4-methylphenyl)carbamoyl]furan-3-carboxylic acid
CID 104607465
5-[2-cyanoethyl(methyl)carbamoyl]furan-3-carboxylic acid
CID 104607071
5-[5-hydroxypentyl(methyl)carbamoyl]furan-3-carboxylic acid
CID 107201888
5-acetylfuran-3-carboxylic acid
CID 10654434
4-amino-N-ethyl-3-hydroxy-N-(2-methoxyethyl)benzamide
CID 107074866
3-amino-4-bromo-N-ethyl-N-(2-methoxyethyl)benzamide
CID 61443550
N-ethyl-4-(ethylamino)-3,5-difluoro-N-(2-methoxyethyl)benzamide
CID 63185704

Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid?
The IUPAC name of 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid (CID 104607286) is 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid.
What is the SMILES notation for 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid?
The canonical SMILES for 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid is CCN(CCOC)C(=O)c1cc(C(=O)O)co1.
What is the InChIKey of 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid?
The InChIKey is WUHQAXYQHJMPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO5/c1-3-12(4-5-16-2)10(13)9-6-8(7-17-9)11(14)15/h6-7H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid?
5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid has a molecular weight of 241.24 g/mol, XLogP of 1.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(2-methoxyethyl)carbamoyl]furan-3-carboxylic acid is sourced from PubChem (CID 104607286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).