2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide

C18H19Cl2NO2 — CID 60540563

IUPAC2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(C)c1
InChIInChI=1S/C18H19Cl2NO2/c1-3-8-23-14-5-7-17(12(2)9-14)21-18(22)11-13-4-6-15(19)16(20)10-13/h4-7,9-10H,3,8,11H2,1-2H3,(H,21,22)
InChIKeyMOSSCFWYZXRNSF-UHFFFAOYSA-N
MW352.26 g/mol
LogP5.27
Rot. Bonds6

About 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide

2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide (PubChem CID 60540563) has the molecular formula C18H19Cl2NO2 and a molecular weight of 352.26 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide
PubChem CID60540563
Molecular FormulaC18H19Cl2NO2
Molecular Weight352.26 g/mol
Exact Mass351.08
IUPAC Name2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(C)c1
InChIInChI=1S/C18H19Cl2NO2/c1-3-8-23-14-5-7-17(12(2)9-14)21-18(22)11-13-4-6-15(19)16(20)10-13/h4-7,9-10H,3,8,11H2,1-2H3,(H,21,22)
InChIKeyMOSSCFWYZXRNSF-UHFFFAOYSA-N
XLogP5.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.26
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methyl-4-propoxyphenyl)carbamic acid
CID 118108315
N-(4-amino-2-methylphenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045442
2-(3,4-dichlorophenyl)-N-(2-methylphenyl)acetamide
CID 2599145
4-[3-(2-methyl-4-propoxyanilino)-3-oxopropyl]benzoic acid
CID 119181908
N-(2-methyl-4-propoxyphenyl)-3-[(2-phenylacetyl)amino]propanamide
CID 55904755
3-amino-N-(2-methyl-4-propoxyphenyl)butanamide;hydrochloride
CID 119739467
4-amino-N-(2-methyl-4-propoxyphenyl)pentanamide
CID 120560885
4-(4-chloro-3-methylphenoxy)-N-(2,4-dimethylphenyl)butanamide
CID 19191212
5-[(2-methyl-4-propoxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120685180
4-(4-chloro-3-ethylphenoxy)-N-(2,4-dimethylphenyl)butanamide
CID 20580448
3-amino-N-(4-butoxy-2-methylphenyl)propanamide
CID 39353448
N-(4-amino-2-methylphenyl)-2-(3,4-dichlorophenoxy)acetamide
CID 60999929

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide (CID 60540563) is 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide is CCCOc1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(C)c1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide?
The InChIKey is MOSSCFWYZXRNSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO2/c1-3-8-23-14-5-7-17(12(2)9-14)21-18(22)11-13-4-6-15(19)16(20)10-13/h4-7,9-10H,3,8,11H2,1-2H3,(H,21,22).
What are the key properties of 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide?
2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide has a molecular weight of 352.26 g/mol, XLogP of 5.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-(2-methyl-4-propoxyphenyl)acetamide is sourced from PubChem (CID 60540563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).