4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide

C14H21FN2O2 — CID 64855070

IUPAC4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide
SMILESCNC(C)(CC(C)Oc1cc(C)ccc1F)C(N)=O
InChIInChI=1S/C14H21FN2O2/c1-9-5-6-11(15)12(7-9)19-10(2)8-14(3,17-4)13(16)18/h5-7,10,17H,8H2,1-4H3,(H2,16,18)
InChIKeyZXXUTEYQEBVGNG-UHFFFAOYSA-N
MW268.33 g/mol
LogP1.75
Rot. Bonds6

About 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide

4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide (PubChem CID 64855070) has the molecular formula C14H21FN2O2 and a molecular weight of 268.33 g/mol. Its IUPAC name is 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide.

Molecular Properties

Compound Name4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide
PubChem CID64855070
Molecular FormulaC14H21FN2O2
Molecular Weight268.33 g/mol
Exact Mass268.16
IUPAC Name4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide
SMILESCNC(C)(CC(C)Oc1cc(C)ccc1F)C(N)=O
InChIInChI=1S/C14H21FN2O2/c1-9-5-6-11(15)12(7-9)19-10(2)8-14(3,17-4)13(16)18/h5-7,10,17H,8H2,1-4H3,(H2,16,18)
InChIKeyZXXUTEYQEBVGNG-UHFFFAOYSA-N
XLogP1.75
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide?
The IUPAC name of 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide (CID 64855070) is 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide.
What is the SMILES notation for 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide?
The canonical SMILES for 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide is CNC(C)(CC(C)Oc1cc(C)ccc1F)C(N)=O.
What is the InChIKey of 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide?
The InChIKey is ZXXUTEYQEBVGNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O2/c1-9-5-6-11(15)12(7-9)19-10(2)8-14(3,17-4)13(16)18/h5-7,10,17H,8H2,1-4H3,(H2,16,18).
What are the key properties of 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide?
4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide has a molecular weight of 268.33 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-5-methylphenoxy)-2-methyl-2-(methylamino)pentanamide is sourced from PubChem (CID 64855070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).