2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide

C15H15FN2O2 — CID 106485411

IUPAC2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide
SMILESCNCc1ccccc1Oc1cccc(F)c1C(N)=O
InChIInChI=1S/C15H15FN2O2/c1-18-9-10-5-2-3-7-12(10)20-13-8-4-6-11(16)14(13)15(17)19/h2-8,18H,9H2,1H3,(H2,17,19)
InChIKeyRKCFBUPHAJOBOY-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.44
Rot. Bonds5

About 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide

2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide (PubChem CID 106485411) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide.

Molecular Properties

Compound Name2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide
PubChem CID106485411
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide
SMILESCNCc1ccccc1Oc1cccc(F)c1C(N)=O
InChIInChI=1S/C15H15FN2O2/c1-18-9-10-5-2-3-7-12(10)20-13-8-4-6-11(16)14(13)15(17)19/h2-8,18H,9H2,1H3,(H2,17,19)
InChIKeyRKCFBUPHAJOBOY-UHFFFAOYSA-N
XLogP2.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide?
The IUPAC name of 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide (CID 106485411) is 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide.
What is the SMILES notation for 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide?
The canonical SMILES for 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide is CNCc1ccccc1Oc1cccc(F)c1C(N)=O.
What is the InChIKey of 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide?
The InChIKey is RKCFBUPHAJOBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-18-9-10-5-2-3-7-12(10)20-13-8-4-6-11(16)14(13)15(17)19/h2-8,18H,9H2,1H3,(H2,17,19).
What are the key properties of 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide?
2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide has a molecular weight of 274.30 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-[2-(methylaminomethyl)phenoxy]benzamide is sourced from PubChem (CID 106485411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).