4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide

C16H16FNO3 — CID 110762258

IUPAC4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide
SMILESCCOc1ccc(C(=O)Nc2cccc(OC)c2)cc1F
InChIInChI=1S/C16H16FNO3/c1-3-21-15-8-7-11(9-14(15)17)16(19)18-12-5-4-6-13(10-12)20-2/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyRJSWWSOWHFCGLV-UHFFFAOYSA-N
MW289.31 g/mol
LogP3.49
Rot. Bonds5

About 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide

4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide (PubChem CID 110762258) has the molecular formula C16H16FNO3 and a molecular weight of 289.31 g/mol. Its IUPAC name is 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide
PubChem CID110762258
Molecular FormulaC16H16FNO3
Molecular Weight289.31 g/mol
Exact Mass289.11
IUPAC Name4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide
SMILESCCOc1ccc(C(=O)Nc2cccc(OC)c2)cc1F
InChIInChI=1S/C16H16FNO3/c1-3-21-15-8-7-11(9-14(15)17)16(19)18-12-5-4-6-13(10-12)20-2/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyRJSWWSOWHFCGLV-UHFFFAOYSA-N
XLogP3.49
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide
CID 26914609
3-bromo-N-(4-ethoxy-3-fluorophenyl)-4-fluorobenzamide
CID 103706990
ethyl 3-[(3-fluoro-4-methoxybenzoyl)amino]benzoate
CID 9228357
N-(3-acetamidophenyl)-4-ethoxy-3-methoxybenzamide
CID 26103493
3-amino-5-ethoxy-N-(3-methoxyphenyl)benzamide
CID 81094945
3-fluoro-N-(3-methoxyphenyl)-4-(3-methoxy-2-pyridinyl)benzamide
CID 59673094
3-methoxy-N-(3-methoxyphenyl)-4-prop-2-enoxybenzamide
CID 27167629
4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 17362963
3-amino-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 16785828
1-N-(4-fluorophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057463
4-(aminomethyl)-N-(4-ethoxy-3-fluorophenyl)benzamide
CID 115733832

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide (CID 110762258) is 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide is CCOc1ccc(C(=O)Nc2cccc(OC)c2)cc1F.
What is the InChIKey of 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide?
The InChIKey is RJSWWSOWHFCGLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO3/c1-3-21-15-8-7-11(9-14(15)17)16(19)18-12-5-4-6-13(10-12)20-2/h4-10H,3H2,1-2H3,(H,18,19).
What are the key properties of 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide?
4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide has a molecular weight of 289.31 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 110762258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).