N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide

C17H18ClNO2 — CID 4953273

IUPACN-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide
SMILESCCc1ccc(OC(C)C(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C17H18ClNO2/c1-3-13-8-10-14(11-9-13)21-12(2)17(20)19-16-7-5-4-6-15(16)18/h4-12H,3H2,1-2H3,(H,19,20)
InChIKeyBZBIAWRCMAFWIY-UHFFFAOYSA-N
MW303.79 g/mol
LogP4.31
Rot. Bonds5

About N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide

N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide (PubChem CID 4953273) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide
PubChem CID4953273
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC NameN-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide
SMILESCCc1ccc(OC(C)C(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C17H18ClNO2/c1-3-13-8-10-14(11-9-13)21-12(2)17(20)19-16-7-5-4-6-15(16)18/h4-12H,3H2,1-2H3,(H,19,20)
InChIKeyBZBIAWRCMAFWIY-UHFFFAOYSA-N
XLogP4.31
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 ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-phenoxypropanamide
CID 2897832
(2R)-N-(2-chlorophenyl)-2-phenoxypropanamide
CID 837154
2-(4-ethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 17093767
N-(2-chlorophenyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 4953593
N-(2-chlorophenyl)-2-(4-methylphenoxy)propanamide
CID 2983629
(2R)-N-(2,4-dichlorophenyl)-2-(4-ethylphenoxy)propanamide
CID 9236171
(2R)-N-(2-bromophenyl)-2-(4-ethylphenoxy)propanamide
CID 9236709
2-(4-ethylphenoxy)-N-naphthalen-1-ylpropanamide
CID 4953259
N-(2-chlorophenyl)-2-(4-methylsulfonylphenoxy)propanamide
CID 51236628
(2S)-2-(3-chlorophenoxy)-N-(2-chlorophenyl)propanamide
CID 966242
N-(2-chlorophenyl)-4-[1-(2-ethoxyanilino)-1-oxopropan-2-yl]oxybenzamide
CID 2968671
N-(2,3-dichlorophenyl)-2-phenoxypropanamide
CID 2897939

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide?
The IUPAC name of N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide (CID 4953273) is N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide is CCc1ccc(OC(C)C(=O)Nc2ccccc2Cl)cc1.
What is the InChIKey of N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide?
The InChIKey is BZBIAWRCMAFWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-3-13-8-10-14(11-9-13)21-12(2)17(20)19-16-7-5-4-6-15(16)18/h4-12H,3H2,1-2H3,(H,19,20).
What are the key properties of N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide?
N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide has a molecular weight of 303.79 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(4-ethylphenoxy)propanamide is sourced from PubChem (CID 4953273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).