4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide

C16H16N2O3 — CID 30843274

IUPAC4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C16H16N2O3/c1-2-21-14-6-4-3-5-13(14)18-16(20)12-9-7-11(8-10-12)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20)
InChIKeySTKCOVBZMFQMIW-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.44
Rot. Bonds5

About 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide

4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide (PubChem CID 30843274) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
PubChem CID30843274
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C16H16N2O3/c1-2-21-14-6-4-3-5-13(14)18-16(20)12-9-7-11(8-10-12)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20)
InChIKeySTKCOVBZMFQMIW-UHFFFAOYSA-N
XLogP2.44
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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1-N-(3-chlorophenyl)-4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
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N-(2-ethoxyphenyl)-4-[(4-methoxybenzoyl)amino]benzamide
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1-N,4-N-bis(2-butoxyphenyl)benzene-1,4-dicarboxamide
CID 17087319
N-(2-ethoxyphenyl)-4-heptoxybenzamide
CID 4950665
4-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethoxy]benzamide
CID 8607962
3,5-dichloro-N-(2-ethoxyphenyl)benzamide
CID 2442507
3,4,5-triethoxy-N-(2-propoxyphenyl)benzamide
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4-(cyclopropanecarbonylamino)-N-(2-ethoxyphenyl)benzamide
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CID 2590897

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide?
The IUPAC name of 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide (CID 30843274) is 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide is CCOc1ccccc1NC(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide?
The InChIKey is STKCOVBZMFQMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-2-21-14-6-4-3-5-13(14)18-16(20)12-9-7-11(8-10-12)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide?
4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 30843274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).