(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide

C18H19Cl2NO2 — CID 9173663

IUPAC(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)NCc2ccc(Cl)cc2Cl)cc1C
InChIInChI=1S/C18H19Cl2NO2/c1-11-4-7-16(8-12(11)2)23-13(3)18(22)21-10-14-5-6-15(19)9-17(14)20/h4-9,13H,10H2,1-3H3,(H,21,22)/t13-/m1/s1
InChIKeyKUZRXFPYXVFMCK-CYBMUJFWSA-N
MW352.26 g/mol
LogP4.69
Rot. Bonds5

About (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide

(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide (PubChem CID 9173663) has the molecular formula C18H19Cl2NO2 and a molecular weight of 352.26 g/mol. Its IUPAC name is (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide
PubChem CID9173663
Molecular FormulaC18H19Cl2NO2
Molecular Weight352.26 g/mol
Exact Mass351.08
IUPAC Name(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)NCc2ccc(Cl)cc2Cl)cc1C
InChIInChI=1S/C18H19Cl2NO2/c1-11-4-7-16(8-12(11)2)23-13(3)18(22)21-10-14-5-6-15(19)9-17(14)20/h4-9,13H,10H2,1-3H3,(H,21,22)/t13-/m1/s1
InChIKeyKUZRXFPYXVFMCK-CYBMUJFWSA-N
XLogP4.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.26
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-dichlorophenyl)methyl]-2-(4-methoxyphenoxy)propanamide
CID 21173910
(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(2-methoxyphenoxy)propanamide
CID 9172784
(2S)-2-(4-chloro-3-methylphenoxy)-N-[(2-methylphenyl)methyl]propanamide
CID 99132986
(2S)-2-(3-chlorophenoxy)-N-[(2-chlorophenyl)methyl]propanamide
CID 894862
N-[(2,4-dichlorophenyl)methyl]-2-(4-methylphenoxy)butanamide
CID 54776466
(2R)-2-(4-cyanophenoxy)-N-[2-(2,4-dichlorophenyl)ethyl]propanamide
CID 9246467
(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 100659224
N-[(2-chlorophenyl)methyl]-2-(4-iodophenoxy)propanamide
CID 24511812
N-[(2-chlorophenyl)methyl]-2-(3-methylphenoxy)propanamide
CID 6915501
(2S)-N-[(2,4-dichlorophenyl)methyl]-2-(4-fluorophenoxy)butanamide
CID 99956967
2-(4-chlorophenoxy)-N-[3-[2-(4-chlorophenoxy)propanoylamino]propyl]propanamide
CID 4944309
N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266186

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide?
The IUPAC name of (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide (CID 9173663) is (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide?
The canonical SMILES for (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide is Cc1ccc(O[C@H](C)C(=O)NCc2ccc(Cl)cc2Cl)cc1C.
What is the InChIKey of (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide?
The InChIKey is KUZRXFPYXVFMCK-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H19Cl2NO2/c1-11-4-7-16(8-12(11)2)23-13(3)18(22)21-10-14-5-6-15(19)9-17(14)20/h4-9,13H,10H2,1-3H3,(H,21,22)/t13-/m1/s1.
What are the key properties of (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide?
(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide has a molecular weight of 352.26 g/mol, XLogP of 4.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2,4-dichlorophenyl)methyl]-2-(3,4-dimethylphenoxy)propanamide is sourced from PubChem (CID 9173663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).