2-(2-amino-4-fluoro-5-methylphenoxy)benzamide

C14H13FN2O2 — CID 103590954

IUPAC2-(2-amino-4-fluoro-5-methylphenoxy)benzamide
SMILESCc1cc(Oc2ccccc2C(N)=O)c(N)cc1F
InChIInChI=1S/C14H13FN2O2/c1-8-6-13(11(16)7-10(8)15)19-12-5-3-2-4-9(12)14(17)18/h2-7H,16H2,1H3,(H2,17,18)
InChIKeyGMSLQFWENXEHLT-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.61
Rot. Bonds3

About 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide

2-(2-amino-4-fluoro-5-methylphenoxy)benzamide (PubChem CID 103590954) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide.

Molecular Properties

Compound Name2-(2-amino-4-fluoro-5-methylphenoxy)benzamide
PubChem CID103590954
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC Name2-(2-amino-4-fluoro-5-methylphenoxy)benzamide
SMILESCc1cc(Oc2ccccc2C(N)=O)c(N)cc1F
InChIInChI=1S/C14H13FN2O2/c1-8-6-13(11(16)7-10(8)15)19-12-5-3-2-4-9(12)14(17)18/h2-7H,16H2,1H3,(H2,17,18)
InChIKeyGMSLQFWENXEHLT-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-(4-amino-2-fluoro-5-methoxyphenoxy)benzamide
CID 107259815
2-(2-amino-5-chlorophenoxy)benzamide
CID 113315871
2-(5-chloro-2-methylphenoxy)-5-fluoro-4-methylaniline
CID 103591054
2-(3-amino-5-fluorophenoxy)benzamide
CID 80753129
2-(3-methylphenoxy)benzamide
CID 70968841
4-fluoro-2,5-dimethylbenzamide
CID 119025196
5-fluoro-4-methyl-2-propan-2-yloxybenzamide
CID 59113922
2-amino-5-(2-fluoro-3-methylphenoxy)benzamide
CID 107659972
5-fluoro-4-methyl-2-pyridin-3-yloxyaniline
CID 103590987
2-(3-amino-5-methoxyphenoxy)benzamide
CID 80747937
5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide
CID 114408553
2-[2-(hydroxymethyl)phenoxy]benzamide
CID 28945887

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide?
The IUPAC name of 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide (CID 103590954) is 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide.
What is the SMILES notation for 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide?
The canonical SMILES for 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide is Cc1cc(Oc2ccccc2C(N)=O)c(N)cc1F.
What is the InChIKey of 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide?
The InChIKey is GMSLQFWENXEHLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c1-8-6-13(11(16)7-10(8)15)19-12-5-3-2-4-9(12)14(17)18/h2-7H,16H2,1H3,(H2,17,18).
What are the key properties of 2-(2-amino-4-fluoro-5-methylphenoxy)benzamide?
2-(2-amino-4-fluoro-5-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-(2-amino-4-fluoro-5-methylphenoxy)benzamide is sourced from PubChem (CID 103590954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).