3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide

C18H18Cl2N2O3 — CID 55567336

IUPAC3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide
SMILESCOCC(=O)Nc1cccc(NC(=O)CCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H18Cl2N2O3/c1-25-11-18(24)22-15-4-2-3-14(10-15)21-17(23)8-6-12-5-7-13(19)9-16(12)20/h2-5,7,9-10H,6,8,11H2,1H3,(H,21,23)(H,22,24)
InChIKeyNVOFZRUJWVKBBB-UHFFFAOYSA-N
MW381.26 g/mol
LogP4.15
Rot. Bonds7

About 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide

3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide (PubChem CID 55567336) has the molecular formula C18H18Cl2N2O3 and a molecular weight of 381.26 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide
PubChem CID55567336
Molecular FormulaC18H18Cl2N2O3
Molecular Weight381.26 g/mol
Exact Mass380.07
IUPAC Name3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide
SMILESCOCC(=O)Nc1cccc(NC(=O)CCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C18H18Cl2N2O3/c1-25-11-18(24)22-15-4-2-3-14(10-15)21-17(23)8-6-12-5-7-13(19)9-16(12)20/h2-5,7,9-10H,6,8,11H2,1H3,(H,21,23)(H,22,24)
InChIKeyNVOFZRUJWVKBBB-UHFFFAOYSA-N
XLogP4.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.26
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-3-(2,4-dichlorophenyl)propanamide
CID 100606597
3-(2,4-dichlorophenyl)-N-(3-methylsulfanylphenyl)propanamide
CID 100606198
3-(2,4-dichlorophenyl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 100605483
N-(3-acetamidophenyl)-3-[2-(2,4-dichlorophenyl)ethylamino]propanamide
CID 109033478
N-[4-[(2,4-dichlorophenyl)methylcarbamoylamino]phenyl]-2-methoxyacetamide
CID 55697658
3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide
CID 100605346
N-(3-acetamidophenyl)-2-(2,4-dichlorophenyl)acetamide
CID 7914502
N-(4-bromo-3-chlorophenyl)-3-(2,4-dichlorophenyl)propanamide
CID 100606713
3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 46879470
N-[3-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]butanamide
CID 1361275
N-[3-[5-(2,4-dichlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl]-2-methoxyacetamide
CID 35521831
3-(2,4-dichlorophenyl)-N-methylpropanamide
CID 60731277

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide (CID 55567336) is 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide is COCC(=O)Nc1cccc(NC(=O)CCc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide?
The InChIKey is NVOFZRUJWVKBBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O3/c1-25-11-18(24)22-15-4-2-3-14(10-15)21-17(23)8-6-12-5-7-13(19)9-16(12)20/h2-5,7,9-10H,6,8,11H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide?
3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide has a molecular weight of 381.26 g/mol, XLogP of 4.15, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide is sourced from PubChem (CID 55567336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).