4-(furan-2-yl)-N-(2-methoxyethyl)benzamide

C14H15NO3 — CID 168525529

IUPAC4-(furan-2-yl)-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(-c2ccco2)cc1
InChIInChI=1S/C14H15NO3/c1-17-10-8-15-14(16)12-6-4-11(5-7-12)13-3-2-9-18-13/h2-7,9H,8,10H2,1H3,(H,15,16)
InChIKeyRNCRVQFWDLJVNW-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.32
Rot. Bonds5

About 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide

4-(furan-2-yl)-N-(2-methoxyethyl)benzamide (PubChem CID 168525529) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-(furan-2-yl)-N-(2-methoxyethyl)benzamide
PubChem CID168525529
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name4-(furan-2-yl)-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(-c2ccco2)cc1
InChIInChI=1S/C14H15NO3/c1-17-10-8-15-14(16)12-6-4-11(5-7-12)13-3-2-9-18-13/h2-7,9H,8,10H2,1H3,(H,15,16)
InChIKeyRNCRVQFWDLJVNW-UHFFFAOYSA-N
XLogP2.32
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide (CID 168525529) is 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1ccc(-c2ccco2)cc1.
What is the InChIKey of 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide?
The InChIKey is RNCRVQFWDLJVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-17-10-8-15-14(16)12-6-4-11(5-7-12)13-3-2-9-18-13/h2-7,9H,8,10H2,1H3,(H,15,16).
What are the key properties of 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide?
4-(furan-2-yl)-N-(2-methoxyethyl)benzamide has a molecular weight of 245.28 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 168525529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).