N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide

C18H19Cl2NO3 — CID 43077370

IUPACN-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide
SMILESCOc1cccc(COC(C)C(=O)NCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H19Cl2NO3/c1-12(24-11-13-4-3-5-16(8-13)23-2)18(22)21-10-14-6-7-15(19)9-17(14)20/h3-9,12H,10-11H2,1-2H3,(H,21,22)
InChIKeyLTFNHKMJFGZSJZ-UHFFFAOYSA-N
MW368.26 g/mol
LogP4.22
Rot. Bonds7

About N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide

N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide (PubChem CID 43077370) has the molecular formula C18H19Cl2NO3 and a molecular weight of 368.26 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide
PubChem CID43077370
Molecular FormulaC18H19Cl2NO3
Molecular Weight368.26 g/mol
Exact Mass367.07
IUPAC NameN-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide
SMILESCOc1cccc(COC(C)C(=O)NCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H19Cl2NO3/c1-12(24-11-13-4-3-5-16(8-13)23-2)18(22)21-10-14-6-7-15(19)9-17(14)20/h3-9,12H,10-11H2,1-2H3,(H,21,22)
InChIKeyLTFNHKMJFGZSJZ-UHFFFAOYSA-N
XLogP4.22
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.26
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide (CID 43077370) is N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide is COc1cccc(COC(C)C(=O)NCc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide?
The InChIKey is LTFNHKMJFGZSJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO3/c1-12(24-11-13-4-3-5-16(8-13)23-2)18(22)21-10-14-6-7-15(19)9-17(14)20/h3-9,12H,10-11H2,1-2H3,(H,21,22).
What are the key properties of N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide?
N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide has a molecular weight of 368.26 g/mol, XLogP of 4.22, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide is sourced from PubChem (CID 43077370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).