5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide

C15H15FN2O3 — CID 106956184

IUPAC5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide
SMILESCOc1cccc(COc2ccc(N)cc2C(N)=O)c1F
InChIInChI=1S/C15H15FN2O3/c1-20-13-4-2-3-9(14(13)16)8-21-12-6-5-10(17)7-11(12)15(18)19/h2-7H,8,17H2,1H3,(H2,18,19)
InChIKeyDCLIMELQLIZIJL-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.09
Rot. Bonds5

About 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide

5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide (PubChem CID 106956184) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide.

Molecular Properties

Compound Name5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide
PubChem CID106956184
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC Name5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide
SMILESCOc1cccc(COc2ccc(N)cc2C(N)=O)c1F
InChIInChI=1S/C15H15FN2O3/c1-20-13-4-2-3-9(14(13)16)8-21-12-6-5-10(17)7-11(12)15(18)19/h2-7H,8,17H2,1H3,(H2,18,19)
InChIKeyDCLIMELQLIZIJL-UHFFFAOYSA-N
XLogP2.09
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.09
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

5-amino-2-[(2-bromo-5-fluorophenyl)methoxy]benzamide
CID 106956029
5-amino-2-[(2-carbamoylphenyl)methoxy]benzoic acid
CID 43379987
5-amino-2-[(2,5-dimethylphenyl)methoxy]benzamide
CID 106956236
1-[(2-ethylphenoxy)methyl]-2-fluoro-3-methoxybenzene
CID 104795197
2-[2-[(5-amino-2-methoxyphenoxy)methyl]phenyl]acetic acid
CID 115460494
3-[(2-chloro-3-fluorophenyl)methoxy]-4-methoxyaniline
CID 112651662
4-amino-2-[(2-methoxyphenyl)methoxy]benzoic acid
CID 106954690
5-amino-2-[(3-bromo-2,6-difluorophenyl)methoxy]benzamide
CID 106264677
2-[5-bromo-2-[(2-fluoro-3-methoxyphenyl)methoxy]phenyl]ethanamine
CID 104794308
2-[(2-amino-5-fluorophenyl)methoxy]benzamide
CID 43443894
3-methoxy-4-[(2-methoxyphenyl)methoxy]aniline
CID 22112878
1-[5-fluoro-2-[(2-fluoro-3-methoxyphenyl)methoxy]phenyl]ethanol
CID 104792501

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide?
The IUPAC name of 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide (CID 106956184) is 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide.
What is the SMILES notation for 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide?
The canonical SMILES for 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide is COc1cccc(COc2ccc(N)cc2C(N)=O)c1F.
What is the InChIKey of 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide?
The InChIKey is DCLIMELQLIZIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c1-20-13-4-2-3-9(14(13)16)8-21-12-6-5-10(17)7-11(12)15(18)19/h2-7H,8,17H2,1H3,(H2,18,19).
What are the key properties of 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide?
5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide has a molecular weight of 290.29 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[(2-fluoro-3-methoxyphenyl)methoxy]benzamide is sourced from PubChem (CID 106956184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).