2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide

C17H17ClFNO2 — CID 51958272

IUPAC2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
SMILESC[C@@H](NC(=O)COCc1ccccc1Cl)c1ccc(F)cc1
InChIInChI=1S/C17H17ClFNO2/c1-12(13-6-8-15(19)9-7-13)20-17(21)11-22-10-14-4-2-3-5-16(14)18/h2-9,12H,10-11H2,1H3,(H,20,21)/t12-/m1/s1
InChIKeySSGRUWIVHRRRPM-GFCCVEGCSA-N
MW321.78 g/mol
LogP3.87
Rot. Bonds6

About 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide

2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide (PubChem CID 51958272) has the molecular formula C17H17ClFNO2 and a molecular weight of 321.78 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
PubChem CID51958272
Molecular FormulaC17H17ClFNO2
Molecular Weight321.78 g/mol
Exact Mass321.09
IUPAC Name2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
SMILESC[C@@H](NC(=O)COCc1ccccc1Cl)c1ccc(F)cc1
InChIInChI=1S/C17H17ClFNO2/c1-12(13-6-8-15(19)9-7-13)20-17(21)11-22-10-14-4-2-3-5-16(14)18/h2-9,12H,10-11H2,1H3,(H,20,21)/t12-/m1/s1
InChIKeySSGRUWIVHRRRPM-GFCCVEGCSA-N
XLogP3.87
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.78
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chlorophenyl)methylsulfanyl]-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide
CID 28956969
methyl (2S)-2-[[2-[(2-chlorophenyl)methoxy]acetyl]amino]propanoate
CID 87040393
N-[(1R)-1-(4-fluorophenyl)ethyl]-2-propoxyacetamide
CID 114018739
(2S)-1-[(2-chlorophenyl)methoxy]-3-[[(1S)-1-(4-fluorophenyl)ethyl]amino]propan-2-ol
CID 2118266
2-(2-bromophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 42980776
N-[1-(4-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 78916745
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-phenylacetamide
CID 2713141
2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 16546160
[2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]-2-oxoethyl] 4-chlorobenzoate
CID 2629341
[2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-chloro-6-fluorobenzoate
CID 7820806
2-[2-oxo-2-(1-phenylethylamino)ethoxy]-N-(1-phenylethyl)acetamide
CID 85140182
2-(2-ethoxyphenoxy)-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide
CID 7930315

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide (CID 51958272) is 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide is C[C@@H](NC(=O)COCc1ccccc1Cl)c1ccc(F)cc1.
What is the InChIKey of 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is SSGRUWIVHRRRPM-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H17ClFNO2/c1-12(13-6-8-15(19)9-7-13)20-17(21)11-22-10-14-4-2-3-5-16(14)18/h2-9,12H,10-11H2,1H3,(H,20,21)/t12-/m1/s1.
What are the key properties of 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 321.78 g/mol, XLogP of 3.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 51958272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).