N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide

C21H17NO3 — CID 18876152

IUPACN-(4-ethoxyphenyl)dibenzofuran-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C21H17NO3/c1-2-24-16-10-8-15(9-11-16)22-21(23)14-7-12-20-18(13-14)17-5-3-4-6-19(17)25-20/h3-13H,2H2,1H3,(H,22,23)
InChIKeyZRBZRIDPFPDNDD-UHFFFAOYSA-N
MW331.37 g/mol
LogP5.24
Rot. Bonds4

About N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide

N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide (PubChem CID 18876152) has the molecular formula C21H17NO3 and a molecular weight of 331.37 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)dibenzofuran-2-carboxamide
PubChem CID18876152
Molecular FormulaC21H17NO3
Molecular Weight331.37 g/mol
Exact Mass331.12
IUPAC NameN-(4-ethoxyphenyl)dibenzofuran-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C21H17NO3/c1-2-24-16-10-8-15(9-11-16)22-21(23)14-7-12-20-18(13-14)17-5-3-4-6-19(17)25-20/h3-13H,2H2,1H3,(H,22,23)
InChIKeyZRBZRIDPFPDNDD-UHFFFAOYSA-N
XLogP5.24
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.37
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-3-yl-3,4-diethoxybenzamide
CID 100535304
3-benzamido-N-(4-ethoxyphenyl)-1-benzofuran-2-carboxamide
CID 20875337
3-[(4-ethoxybenzoyl)amino]-N-(4-methylphenyl)-1-benzofuran-2-carboxamide
CID 20875380
N-(4-ethoxyphenyl)naphthalene-2-carboxamide
CID 2600548
N-(3,4-dimethylphenyl)dibenzofuran-2-carboxamide
CID 18876126
[2-[4-[(4-ethoxyphenyl)carbamoyl]anilino]-2-oxoethyl] 4-oxochromene-2-carboxylate
CID 42969814
N-dibenzofuran-2-yl-2-ethoxybenzamide
CID 16552367
N-[4-(4-ethoxyphenoxy)phenyl]-3-methyl-1-benzofuran-2-carboxamide
CID 7925267
N-(4-ethoxyphenyl)-3-[(3-nitrobenzoyl)amino]-1-benzofuran-2-carboxamide
CID 16814634
2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide
CID 2635783
N-propyldibenzofuran-2-carboxamide
CID 19048225
N-(4-ethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 4952680

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide (CID 18876152) is N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide is CCOc1ccc(NC(=O)c2ccc3oc4ccccc4c3c2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide?
The InChIKey is ZRBZRIDPFPDNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17NO3/c1-2-24-16-10-8-15(9-11-16)22-21(23)14-7-12-20-18(13-14)17-5-3-4-6-19(17)25-20/h3-13H,2H2,1H3,(H,22,23).
What are the key properties of N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide?
N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide has a molecular weight of 331.37 g/mol, XLogP of 5.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide is sourced from PubChem (CID 18876152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).