2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide

C14H13FN2O3 — CID 114764190

IUPAC2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide
SMILESNc1c(O)cccc1OCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H13FN2O3/c15-9-3-1-4-10(7-9)17-13(19)8-20-12-6-2-5-11(18)14(12)16/h1-7,18H,8,16H2,(H,17,19)
InChIKeyXDVDUTLVELXEDP-UHFFFAOYSA-N
MW276.27 g/mol
LogP2.13
Rot. Bonds4

About 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide

2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide (PubChem CID 114764190) has the molecular formula C14H13FN2O3 and a molecular weight of 276.27 g/mol. Its IUPAC name is 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide
PubChem CID114764190
Molecular FormulaC14H13FN2O3
Molecular Weight276.27 g/mol
Exact Mass276.09
IUPAC Name2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide
SMILESNc1c(O)cccc1OCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H13FN2O3/c15-9-3-1-4-10(7-9)17-13(19)8-20-12-6-2-5-11(18)14(12)16/h1-7,18H,8,16H2,(H,17,19)
InChIKeyXDVDUTLVELXEDP-UHFFFAOYSA-N
XLogP2.13
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2,6-dimethoxyphenoxy)-N-(3-fluorophenyl)acetamide
CID 7612567
4-[2-(3-fluoroanilino)-2-oxoethoxy]benzamide
CID 7931240
2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-fluorophenyl)acetamide
CID 43379340
2-(2-acetamido-5-acetylphenoxy)-N-(3-fluorophenyl)acetamide
CID 24534011
N-(3-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 17173171
N-(3-fluorophenyl)-2-(3-hydroxy-5-methylphenoxy)acetamide
CID 107679675
2-(3-fluorophenoxy)-N-(3-methoxyphenyl)acetamide
CID 2709796
N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 17172943
[2-(3-fluoroanilino)-2-oxoethyl] 2-(2-benzylphenoxy)acetate
CID 7856125
2-(4-fluorophenoxy)-N-(3-hydroxyphenyl)acetamide
CID 6458581
[2-(3-fluoroanilino)-2-oxoethyl] 2,6-difluorobenzoate
CID 2515125
3-[[2-(2-fluorophenoxy)acetyl]amino]benzamide
CID 51152953

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide (CID 114764190) is 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide is Nc1c(O)cccc1OCC(=O)Nc1cccc(F)c1.
What is the InChIKey of 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide?
The InChIKey is XDVDUTLVELXEDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3/c15-9-3-1-4-10(7-9)17-13(19)8-20-12-6-2-5-11(18)14(12)16/h1-7,18H,8,16H2,(H,17,19).
What are the key properties of 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide?
2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide has a molecular weight of 276.27 g/mol, XLogP of 2.13, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-3-hydroxyphenoxy)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 114764190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).