2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide

C17H18ClNO2 — CID 8866171

IUPAC2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)N[C@H](C)c1ccccc1
InChIInChI=1S/C17H18ClNO2/c1-12(13-6-4-3-5-7-13)19-17(20)11-14-10-15(18)8-9-16(14)21-2/h3-10,12H,11H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeySFCYRPYFOCMFFT-GFCCVEGCSA-N
MW303.79 g/mol
LogP3.77
Rot. Bonds5

About 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide

2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide (PubChem CID 8866171) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
PubChem CID8866171
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC Name2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)N[C@H](C)c1ccccc1
InChIInChI=1S/C17H18ClNO2/c1-12(13-6-4-3-5-7-13)19-17(20)11-14-10-15(18)8-9-16(14)21-2/h3-10,12H,11H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeySFCYRPYFOCMFFT-GFCCVEGCSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-2-methoxyphenyl)-N-[(1S)-1-(3-chlorophenyl)ethyl]acetamide
CID 9092722
N-[1-(4-chlorophenyl)ethyl]-2-(2,5-dimethoxyphenyl)acetamide
CID 43874167
2-(5-chloro-2-methoxyphenyl)-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 51648180
2-(5-chloro-2-methoxyphenyl)-N-(1,3-dihydroxypropan-2-yl)acetamide
CID 65312632
2-(3-fluoro-4-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
CID 9032944
(2R)-2-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]-4-methylpentanoic acid
CID 78975845
2-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]butanoic acid
CID 43388208
[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methyl-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]azanium
CID 7830809
(2S)-2-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]pentanoic acid
CID 107563797
1-(5-chloro-2-methoxyphenyl)-3-(1-phenylethyl)urea
CID 23931434
(2S)-2-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]-3,3-dimethylbutanoic acid
CID 61143813
2-(5-chloro-2-methoxyphenyl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 113351921

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide?
The IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide (CID 8866171) is 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide?
The canonical SMILES for 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide is COc1ccc(Cl)cc1CC(=O)N[C@H](C)c1ccccc1.
What is the InChIKey of 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide?
The InChIKey is SFCYRPYFOCMFFT-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-12(13-6-4-3-5-7-13)19-17(20)11-14-10-15(18)8-9-16(14)21-2/h3-10,12H,11H2,1-2H3,(H,19,20)/t12-/m1/s1.
What are the key properties of 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide?
2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide has a molecular weight of 303.79 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide is sourced from PubChem (CID 8866171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).