(2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide

C18H19Cl2NO3 — CID 7865722

IUPAC(2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(O[C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO3/c1-11(16-9-4-13(19)10-17(16)20)21-18(22)12(2)24-15-7-5-14(23-3)6-8-15/h4-12H,1-3H3,(H,21,22)/t11-,12-/m1/s1
InChIKeyZLFHSYOTUZHOOB-VXGBXAGGSA-N
MW368.26 g/mol
LogP4.65
Rot. Bonds6

About (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide

(2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide (PubChem CID 7865722) has the molecular formula C18H19Cl2NO3 and a molecular weight of 368.26 g/mol. Its IUPAC name is (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide
PubChem CID7865722
Molecular FormulaC18H19Cl2NO3
Molecular Weight368.26 g/mol
Exact Mass367.07
IUPAC Name(2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(O[C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO3/c1-11(16-9-4-13(19)10-17(16)20)21-18(22)12(2)24-15-7-5-14(23-3)6-8-15/h4-12H,1-3H3,(H,21,22)/t11-,12-/m1/s1
InChIKeyZLFHSYOTUZHOOB-VXGBXAGGSA-N
XLogP4.65
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.26
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-(2-methoxyphenoxy)propanamide
CID 7834441
2-(4-chlorophenoxy)-N-[1-(4-methoxyphenyl)ethyl]propanamide
CID 53282264
(2R)-2-(4-chlorophenoxy)-N-[(1S)-1-(4-methoxyphenyl)ethyl]propanamide
CID 99130919
2-(4-chlorophenoxy)-N-[1-(2,5-dimethoxyphenyl)ethyl]propanamide
CID 133224959
2-(3-acetylphenoxy)-N-[1-(2,4-dichlorophenyl)ethyl]propanamide
CID 55326168
(2S)-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-(2-fluorophenoxy)propanamide
CID 7501082
(2S)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(3-nitrophenoxy)propanamide
CID 7865460
(2R)-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-[2-(4-methoxyphenoxy)ethylamino]propanamide
CID 51556510
(2S)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-[2-(4-methoxyphenoxy)ethylamino]propanamide
CID 51556512
2-acetamido-N-[1-(2,4-dichlorophenyl)ethyl]propanamide
CID 78772971
(2S)-2-chloro-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]propanamide
CID 2118112
N-[(2,4-dichlorophenyl)methyl]-2-(4-methoxyphenoxy)propanamide
CID 21173910

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide?
The IUPAC name of (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide (CID 7865722) is (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide?
The canonical SMILES for (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide is COc1ccc(O[C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide?
The InChIKey is ZLFHSYOTUZHOOB-VXGBXAGGSA-N. The full InChI is InChI=1S/C18H19Cl2NO3/c1-11(16-9-4-13(19)10-17(16)20)21-18(22)12(2)24-15-7-5-14(23-3)6-8-15/h4-12H,1-3H3,(H,21,22)/t11-,12-/m1/s1.
What are the key properties of (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide?
(2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide has a molecular weight of 368.26 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 7865722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).