2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide

C14H19FN2O2 — CID 55068862

IUPAC2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide
SMILESNc1cc(F)ccc1OCC(=O)NC1CCCCC1
InChIInChI=1S/C14H19FN2O2/c15-10-6-7-13(12(16)8-10)19-9-14(18)17-11-4-2-1-3-5-11/h6-8,11H,1-5,9,16H2,(H,17,18)
InChIKeyMAWNHKBWDKLNCO-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.24
Rot. Bonds4

About 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide

2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide (PubChem CID 55068862) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide
PubChem CID55068862
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide
SMILESNc1cc(F)ccc1OCC(=O)NC1CCCCC1
InChIInChI=1S/C14H19FN2O2/c15-10-6-7-13(12(16)8-10)19-9-14(18)17-11-4-2-1-3-5-11/h6-8,11H,1-5,9,16H2,(H,17,18)
InChIKeyMAWNHKBWDKLNCO-UHFFFAOYSA-N
XLogP2.24
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide?
The IUPAC name of 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide (CID 55068862) is 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide.
What is the SMILES notation for 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide?
The canonical SMILES for 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide is Nc1cc(F)ccc1OCC(=O)NC1CCCCC1.
What is the InChIKey of 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide?
The InChIKey is MAWNHKBWDKLNCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c15-10-6-7-13(12(16)8-10)19-9-14(18)17-11-4-2-1-3-5-11/h6-8,11H,1-5,9,16H2,(H,17,18).
What are the key properties of 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide?
2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide has a molecular weight of 266.32 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide is sourced from PubChem (CID 55068862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).