3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide

C15H14F2N2O2 — CID 61092470

IUPAC3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide
SMILESNc1ccccc1OCCC(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O2/c16-10-7-11(17)9-12(8-10)19-15(20)5-6-21-14-4-2-1-3-13(14)18/h1-4,7-9H,5-6,18H2,(H,19,20)
InChIKeyNCSUXLNIOVFAAF-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.95
Rot. Bonds5

About 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide

3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide (PubChem CID 61092470) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide.

Molecular Properties

Compound Name3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide
PubChem CID61092470
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide
SMILESNc1ccccc1OCCC(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O2/c16-10-7-11(17)9-12(8-10)19-15(20)5-6-21-14-4-2-1-3-13(14)18/h1-4,7-9H,5-6,18H2,(H,19,20)
InChIKeyNCSUXLNIOVFAAF-UHFFFAOYSA-N
XLogP2.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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

3-(2-aminophenoxy)-N-(4-bromophenyl)propanamide
CID 61091327
N-(2-aminophenyl)-3-(2,5-difluorophenoxy)propanamide
CID 63268657
2-(2-aminophenoxy)-N-(4-fluorophenyl)acetamide
CID 16789642
3-(2-fluorophenoxy)-N-(4-fluorophenyl)propanamide
CID 47097682
4-(2-aminophenoxy)-N-(3-chloro-4-fluorophenyl)butanamide
CID 84553692
4-(2-aminophenoxy)-N-(3,4,5-trimethoxyphenyl)butanamide
CID 84552154
4-(2-aminophenoxy)-N-(3-hydroxyphenyl)butanamide
CID 84553820
3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
CID 61103909
4-(2-aminophenoxy)-N-(3,4-dichlorophenyl)butanamide
CID 84553809
4-(2-aminophenoxy)-N-(3,4-dimethylphenyl)butanamide
CID 84553818
N-(2-amino-2-oxoethyl)-3-(2-aminophenoxy)propanamide
CID 61091283
3-(2-aminophenoxy)propanamide
CID 39869131

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide?
The IUPAC name of 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide (CID 61092470) is 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide.
What is the SMILES notation for 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide?
The canonical SMILES for 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide is Nc1ccccc1OCCC(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide?
The InChIKey is NCSUXLNIOVFAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c16-10-7-11(17)9-12(8-10)19-15(20)5-6-21-14-4-2-1-3-13(14)18/h1-4,7-9H,5-6,18H2,(H,19,20).
What are the key properties of 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide?
3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide has a molecular weight of 292.29 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide is sourced from PubChem (CID 61092470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).