N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide

C11H15FN2O — CID 62648777

IUPACN-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide
SMILESCCN(C)C(=O)c1cccc(F)c1NC
InChIInChI=1S/C11H15FN2O/c1-4-14(3)11(15)8-6-5-7-9(12)10(8)13-2/h5-7,13H,4H2,1-3H3
InChIKeyOEZDTALXIVJSHK-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.96
Rot. Bonds3

About N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide

N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide (PubChem CID 62648777) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide
PubChem CID62648777
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC NameN-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide
SMILESCCN(C)C(=O)c1cccc(F)c1NC
InChIInChI=1S/C11H15FN2O/c1-4-14(3)11(15)8-6-5-7-9(12)10(8)13-2/h5-7,13H,4H2,1-3H3
InChIKeyOEZDTALXIVJSHK-UHFFFAOYSA-N
XLogP1.96
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
The IUPAC name of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide (CID 62648777) is N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide is CCN(C)C(=O)c1cccc(F)c1NC.
What is the InChIKey of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
The InChIKey is OEZDTALXIVJSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-4-14(3)11(15)8-6-5-7-9(12)10(8)13-2/h5-7,13H,4H2,1-3H3.
What are the key properties of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide has a molecular weight of 210.25 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 62648777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).