N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide

C18H19F2NO3 — CID 34703779

IUPACN-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide
SMILESCC[C@H](NC(=O)COc1ccccc1)c1ccccc1OC(F)F
InChIInChI=1S/C18H19F2NO3/c1-2-15(14-10-6-7-11-16(14)24-18(19)20)21-17(22)12-23-13-8-4-3-5-9-13/h3-11,15,18H,2,12H2,1H3,(H,21,22)/t15-/m0/s1
InChIKeyLBISKDORMIUNEB-HNNXBMFYSA-N
MW335.35 g/mol
LogP3.93
Rot. Bonds8

About N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide

N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide (PubChem CID 34703779) has the molecular formula C18H19F2NO3 and a molecular weight of 335.35 g/mol. Its IUPAC name is N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide
PubChem CID34703779
Molecular FormulaC18H19F2NO3
Molecular Weight335.35 g/mol
Exact Mass335.13
IUPAC NameN-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide
SMILESCC[C@H](NC(=O)COc1ccccc1)c1ccccc1OC(F)F
InChIInChI=1S/C18H19F2NO3/c1-2-15(14-10-6-7-11-16(14)24-18(19)20)21-17(22)12-23-13-8-4-3-5-9-13/h3-11,15,18H,2,12H2,1H3,(H,21,22)/t15-/m0/s1
InChIKeyLBISKDORMIUNEB-HNNXBMFYSA-N
XLogP3.93
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.35
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-3-phenoxypropanamide
CID 51942664
N-[1-(2-methoxyphenyl)propyl]-2-[(2-phenoxyacetyl)amino]acetamide
CID 46447077
4-(difluoromethoxy)-N-[2-[1-[2-(difluoromethoxy)phenyl]propylamino]-2-oxoethyl]-3-methoxybenzamide
CID 55656144
4-[4-[1-[2-(difluoromethoxy)phenyl]propylcarbamoyl]phenoxy]benzamide
CID 56545716
N-[(1S)-1-(4-methylphenyl)propyl]-2-phenoxyacetamide
CID 27754182
N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 38979661
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-[2-(difluoromethoxy)phenyl]propyl]acetamide
CID 119721294
4-(4-cyano-2-methoxyphenoxy)-N-[1-[2-(difluoromethoxy)phenyl]propyl]butanamide
CID 46485327
1-(2-bromophenyl)-3-[1-[2-(difluoromethoxy)phenyl]propyl]urea
CID 55696855
3-acetamido-3-[2-(difluoromethoxy)phenyl]propanoic acid
CID 63651224
N-[1-[2-(difluoromethoxy)phenyl]propyl]-3-(1-phenylpyrazol-4-yl)propanamide
CID 55656277
N-[1-[2-(difluoromethoxy)phenyl]propyl]-2-(2-methyl-4-oxoquinazolin-3-yl)acetamide
CID 55656108

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide?
The IUPAC name of N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide (CID 34703779) is N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide?
The canonical SMILES for N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide is CC[C@H](NC(=O)COc1ccccc1)c1ccccc1OC(F)F.
What is the InChIKey of N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide?
The InChIKey is LBISKDORMIUNEB-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H19F2NO3/c1-2-15(14-10-6-7-11-16(14)24-18(19)20)21-17(22)12-23-13-8-4-3-5-9-13/h3-11,15,18H,2,12H2,1H3,(H,21,22)/t15-/m0/s1.
What are the key properties of N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide?
N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide has a molecular weight of 335.35 g/mol, XLogP of 3.93, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-2-phenoxyacetamide is sourced from PubChem (CID 34703779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).