N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide

C15H13F2NO2 — CID 110782203

IUPACN-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NCc1ccc(F)cc1F
InChIInChI=1S/C15H13F2NO2/c16-12-7-6-11(14(17)8-12)9-18-15(19)10-20-13-4-2-1-3-5-13/h1-8H,9-10H2,(H,18,19)
InChIKeyVLEYJVKMZGSPSR-UHFFFAOYSA-N
MW277.27 g/mol
LogP2.66
Rot. Bonds5

About N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide

N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide (PubChem CID 110782203) has the molecular formula C15H13F2NO2 and a molecular weight of 277.27 g/mol. Its IUPAC name is N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide
PubChem CID110782203
Molecular FormulaC15H13F2NO2
Molecular Weight277.27 g/mol
Exact Mass277.09
IUPAC NameN-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NCc1ccc(F)cc1F
InChIInChI=1S/C15H13F2NO2/c16-12-7-6-11(14(17)8-12)9-18-15(19)10-20-13-4-2-1-3-5-13/h1-8H,9-10H2,(H,18,19)
InChIKeyVLEYJVKMZGSPSR-UHFFFAOYSA-N
XLogP2.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-difluorophenyl)methylcarbamic acid
CID 23207286
[2-[(2,4-difluorophenyl)methylamino]-2-oxoethyl] 3-fluorobenzoate
CID 46860456
N-[(2,5-dimethyl-1H-pyrrol-3-yl)methyl]-2-(4-fluorophenoxy)acetamide
CID 110786205
N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 110782201
N-[(1S)-1-(2,4-difluorophenyl)ethyl]-2-phenoxyacetamide
CID 8782142
2-(3,4-dichlorophenoxy)-N-[(2-fluorophenyl)methyl]acetamide
CID 9196943
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-(3-fluorophenoxy)acetamide
CID 9050172
N-[(2-fluorophenyl)methyl]-3-phenoxypropanamide
CID 110755454
2-[2-[(2,4-difluorophenyl)methylamino]-2-oxoethyl]sulfanylacetic acid
CID 112684608
[2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2-phenoxyacetate
CID 2506688
N-[(4-fluorophenyl)methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 7478807
[2-[(2,4-difluorophenyl)methylamino]-2-oxoethyl] 4-methylbenzoate
CID 50926035

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide?
The IUPAC name of N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide (CID 110782203) is N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide?
The canonical SMILES for N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide is O=C(COc1ccccc1)NCc1ccc(F)cc1F.
What is the InChIKey of N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide?
The InChIKey is VLEYJVKMZGSPSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2/c16-12-7-6-11(14(17)8-12)9-18-15(19)10-20-13-4-2-1-3-5-13/h1-8H,9-10H2,(H,18,19).
What are the key properties of N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide?
N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide has a molecular weight of 277.27 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-difluorophenyl)methyl]-2-phenoxyacetamide is sourced from PubChem (CID 110782203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).