N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide

C17H18ClNO2 — CID 8751664

IUPACN-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)N[C@H](C)c2ccc(Cl)cc2)c1
InChIInChI=1S/C17H18ClNO2/c1-12-4-3-5-16(10-12)21-11-17(20)19-13(2)14-6-8-15(18)9-7-14/h3-10,13H,11H2,1-2H3,(H,19,20)/t13-/m1/s1
InChIKeyYUZOHPXVRJMXSM-CYBMUJFWSA-N
MW303.79 g/mol
LogP3.90
Rot. Bonds5

About N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide

N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide (PubChem CID 8751664) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide
PubChem CID8751664
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC NameN-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)N[C@H](C)c2ccc(Cl)cc2)c1
InChIInChI=1S/C17H18ClNO2/c1-12-4-3-5-16(10-12)21-11-17(20)19-13(2)14-6-8-15(18)9-7-14/h3-10,13H,11H2,1-2H3,(H,19,20)/t13-/m1/s1
InChIKeyYUZOHPXVRJMXSM-CYBMUJFWSA-N
XLogP3.90
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 ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylphenoxy)-N-[(1R)-1-(4-methylphenyl)ethyl]acetamide
CID 99132930
2-(3-methylphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 879297
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-(3-methylphenoxy)acetamide
CID 26561387
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(3,4-dimethylphenoxy)acetamide
CID 8751680
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(3-cyanophenoxy)acetamide
CID 7964571
N-[1-(4-chlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 42989419
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-2-(3-methylphenoxy)acetamide
CID 18200818
2-(3-chlorophenoxy)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 99133008
2-(3-methylphenoxy)-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]acetamide
CID 133188150
2-(3-methylphenoxy)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 51140338
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(7-methoxynaphthalen-2-yl)oxyacetamide
CID 7652877
N-[(1R)-1-(4-bromophenyl)ethyl]-2-(4-chlorophenoxy)acetamide
CID 7948935

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide (CID 8751664) is N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)N[C@H](C)c2ccc(Cl)cc2)c1.
What is the InChIKey of N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide?
The InChIKey is YUZOHPXVRJMXSM-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-12-4-3-5-16(10-12)21-11-17(20)19-13(2)14-6-8-15(18)9-7-14/h3-10,13H,11H2,1-2H3,(H,19,20)/t13-/m1/s1.
What are the key properties of N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide?
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide has a molecular weight of 303.79 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 8751664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).