2-amino-5-(2-fluoro-3-methylphenoxy)benzamide

C14H13FN2O2 — CID 107659972

IUPAC2-amino-5-(2-fluoro-3-methylphenoxy)benzamide
SMILESCc1cccc(Oc2ccc(N)c(C(N)=O)c2)c1F
InChIInChI=1S/C14H13FN2O2/c1-8-3-2-4-12(13(8)15)19-9-5-6-11(16)10(7-9)14(17)18/h2-7H,16H2,1H3,(H2,17,18)
InChIKeyOITQAERJOWCWCV-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.61
Rot. Bonds3

About 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide

2-amino-5-(2-fluoro-3-methylphenoxy)benzamide (PubChem CID 107659972) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide.

Molecular Properties

Compound Name2-amino-5-(2-fluoro-3-methylphenoxy)benzamide
PubChem CID107659972
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC Name2-amino-5-(2-fluoro-3-methylphenoxy)benzamide
SMILESCc1cccc(Oc2ccc(N)c(C(N)=O)c2)c1F
InChIInChI=1S/C14H13FN2O2/c1-8-3-2-4-12(13(8)15)19-9-5-6-11(16)10(7-9)14(17)18/h2-7H,16H2,1H3,(H2,17,18)
InChIKeyOITQAERJOWCWCV-UHFFFAOYSA-N
XLogP2.61
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-[2-(trifluoromethyl)phenoxy]benzamide
CID 61312851
methyl 2-amino-5-(3-chloro-2-fluorophenoxy)benzoate
CID 116689734
5-(2-fluoro-3-methylphenoxy)-2-nitroaniline
CID 107662448
1-[2-amino-5-(2-fluorophenoxy)phenyl]ethanone
CID 113433083
2-amino-3-(3,4-dimethylphenoxy)benzamide
CID 115546944
2-amino-5-(2-butan-2-ylphenoxy)benzamide
CID 61305596
1-[3-(2-fluoro-3-methylphenoxy)phenyl]ethanone
CID 107658623
2-amino-5-(5-methyl-2-propan-2-ylphenoxy)benzamide
CID 61311722
2-amino-5-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
CID 103175349
2-fluoro-5-(2-fluorophenoxy)benzamide
CID 175987323
2-amino-5-methoxybenzamide;ethane
CID 142071126
2-amino-3-(3,4-difluorophenoxy)benzamide
CID 113333318

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide?
The IUPAC name of 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide (CID 107659972) is 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide.
What is the SMILES notation for 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide?
The canonical SMILES for 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide is Cc1cccc(Oc2ccc(N)c(C(N)=O)c2)c1F.
What is the InChIKey of 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide?
The InChIKey is OITQAERJOWCWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c1-8-3-2-4-12(13(8)15)19-9-5-6-11(16)10(7-9)14(17)18/h2-7H,16H2,1H3,(H2,17,18).
What are the key properties of 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide?
2-amino-5-(2-fluoro-3-methylphenoxy)benzamide has a molecular weight of 260.27 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-fluoro-3-methylphenoxy)benzamide is sourced from PubChem (CID 107659972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).