4-(3-amino-5-ethoxyphenoxy)benzamide

C15H16N2O3 — CID 80748930

IUPAC4-(3-amino-5-ethoxyphenoxy)benzamide
SMILESCCOc1cc(N)cc(Oc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C15H16N2O3/c1-2-19-13-7-11(16)8-14(9-13)20-12-5-3-10(4-6-12)15(17)18/h3-9H,2,16H2,1H3,(H2,17,18)
InChIKeyACHQZDMXPJOZJI-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.56
Rot. Bonds5

About 4-(3-amino-5-ethoxyphenoxy)benzamide

4-(3-amino-5-ethoxyphenoxy)benzamide (PubChem CID 80748930) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 4-(3-amino-5-ethoxyphenoxy)benzamide.

Molecular Properties

Compound Name4-(3-amino-5-ethoxyphenoxy)benzamide
PubChem CID80748930
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name4-(3-amino-5-ethoxyphenoxy)benzamide
SMILESCCOc1cc(N)cc(Oc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C15H16N2O3/c1-2-19-13-7-11(16)8-14(9-13)20-12-5-3-10(4-6-12)15(17)18/h3-9H,2,16H2,1H3,(H2,17,18)
InChIKeyACHQZDMXPJOZJI-UHFFFAOYSA-N
XLogP2.56
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(4-ethoxyphenyl)benzamide
CID 163572533
3-amino-4-(4-ethoxyphenoxy)benzamide
CID 43448507
3,5-diethoxyaniline
CID 22605063
4-(4-carbamoylphenoxy)benzamide
CID 156597124
4-(3-ethoxy-4-nitrophenoxy)benzamide
CID 133425253
benzamide;1,4-diethoxybenzene
CID 162120306
ethyl 3-amino-5-ethoxybenzoate
CID 58424919
N-(4-carbamoylphenyl)-N'-(4-ethoxyphenyl)oxamide
CID 45001359
methyl 3-amino-5-ethoxybenzoate
CID 45089063
4-(4-amino-3-methylphenoxy)benzamide
CID 43381706
3-(4-ethoxyphenoxy)-5-(trifluoromethyl)aniline
CID 82990854
4-(3-ethoxyphenoxy)benzenecarbothioamide
CID 62338264

Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-5-ethoxyphenoxy)benzamide?
The IUPAC name of 4-(3-amino-5-ethoxyphenoxy)benzamide (CID 80748930) is 4-(3-amino-5-ethoxyphenoxy)benzamide.
What is the SMILES notation for 4-(3-amino-5-ethoxyphenoxy)benzamide?
The canonical SMILES for 4-(3-amino-5-ethoxyphenoxy)benzamide is CCOc1cc(N)cc(Oc2ccc(C(N)=O)cc2)c1.
What is the InChIKey of 4-(3-amino-5-ethoxyphenoxy)benzamide?
The InChIKey is ACHQZDMXPJOZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-2-19-13-7-11(16)8-14(9-13)20-12-5-3-10(4-6-12)15(17)18/h3-9H,2,16H2,1H3,(H2,17,18).
What are the key properties of 4-(3-amino-5-ethoxyphenoxy)benzamide?
4-(3-amino-5-ethoxyphenoxy)benzamide has a molecular weight of 272.30 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-5-ethoxyphenoxy)benzamide is sourced from PubChem (CID 80748930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).