N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide

C15H14F2N2O2 — CID 16789198

IUPACN-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide
SMILESCC(Oc1ccccc1F)C(=O)Nc1ccc(F)cc1N
InChIInChI=1S/C15H14F2N2O2/c1-9(21-14-5-3-2-4-11(14)17)15(20)19-13-7-6-10(16)8-12(13)18/h2-9H,18H2,1H3,(H,19,20)
InChIKeyKWRCOOFRPPWVQB-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.95
Rot. Bonds4

About N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide

N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide (PubChem CID 16789198) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide.

Molecular Properties

Compound NameN-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide
PubChem CID16789198
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC NameN-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide
SMILESCC(Oc1ccccc1F)C(=O)Nc1ccc(F)cc1N
InChIInChI=1S/C15H14F2N2O2/c1-9(21-14-5-3-2-4-11(14)17)15(20)19-13-7-6-10(16)8-12(13)18/h2-9H,18H2,1H3,(H,19,20)
InChIKeyKWRCOOFRPPWVQB-UHFFFAOYSA-N
XLogP2.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-fluorophenyl)-2-phenoxypropanamide
CID 16789399
N-(2,5-difluorophenyl)-2-(2-fluorophenoxy)propanamide
CID 86909512
N-(2-aminophenyl)-2-(2,5-difluorophenoxy)propanamide
CID 63269106
(2R)-N-(2,4-dichlorophenyl)-2-(2-fluorophenoxy)propanamide
CID 7815023
N-(2,4-difluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 53286451
2-[[(2S)-2-(2,4-difluorophenoxy)propanoyl]amino]benzamide
CID 42561609
N-(2-amino-4-fluorophenyl)-2-(2-hydroxyethoxy)propanamide
CID 43823331
N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide
CID 3318555
(2R)-2-(2-fluorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 7815253
(2R)-N-(2-cyanophenyl)-2-(2-fluorophenoxy)propanamide
CID 7894228
(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
CID 31966341
(2R)-N-(3,5-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
CID 31901152

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide?
The IUPAC name of N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide (CID 16789198) is N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide.
What is the SMILES notation for N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide?
The canonical SMILES for N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide is CC(Oc1ccccc1F)C(=O)Nc1ccc(F)cc1N.
What is the InChIKey of N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide?
The InChIKey is KWRCOOFRPPWVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c1-9(21-14-5-3-2-4-11(14)17)15(20)19-13-7-6-10(16)8-12(13)18/h2-9H,18H2,1H3,(H,19,20).
What are the key properties of N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide?
N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide has a molecular weight of 292.29 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-fluorophenyl)-2-(2-fluorophenoxy)propanamide is sourced from PubChem (CID 16789198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).