N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide

C17H18Cl2N2O3 — CID 100829792

IUPACN-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide
SMILESCOc1cc(N)cc(Cl)c1NC(=O)COc1c(C)cc(C)cc1Cl
InChIInChI=1S/C17H18Cl2N2O3/c1-9-4-10(2)17(13(19)5-9)24-8-15(22)21-16-12(18)6-11(20)7-14(16)23-3/h4-7H,8,20H2,1-3H3,(H,21,22)
InChIKeyMGLLXSYZMRVEPT-UHFFFAOYSA-N
MW369.25 g/mol
LogP4.22
Rot. Bonds5

About N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide

N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide (PubChem CID 100829792) has the molecular formula C17H18Cl2N2O3 and a molecular weight of 369.25 g/mol. Its IUPAC name is N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide
PubChem CID100829792
Molecular FormulaC17H18Cl2N2O3
Molecular Weight369.25 g/mol
Exact Mass368.07
IUPAC NameN-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide
SMILESCOc1cc(N)cc(Cl)c1NC(=O)COc1c(C)cc(C)cc1Cl
InChIInChI=1S/C17H18Cl2N2O3/c1-9-4-10(2)17(13(19)5-9)24-8-15(22)21-16-12(18)6-11(20)7-14(16)23-3/h4-7H,8,20H2,1-3H3,(H,21,22)
InChIKeyMGLLXSYZMRVEPT-UHFFFAOYSA-N
XLogP4.22
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.25
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-bromo-2,6-dimethylphenoxy)-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 1191397
N-(2-chloro-4,6-dimethylphenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178203
N-(4-amino-2-chloro-6-methoxyphenyl)acetamide
CID 100828458
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 7233561
[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl] 3-chloro-4-ethoxy-5-methoxybenzoate
CID 41145608
2-(2-chloro-4,6-dimethylphenoxy)-N-(2-ethoxyphenyl)acetamide
CID 23790866
N-(4-amino-2-bromo-6-methylphenyl)-2-(2,4-dichloro-6-methylphenoxy)acetamide
CID 100828348
2-(4-chloro-2,6-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 7642269
2-(2,4-dichloro-6-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 1121099
N-(4-amino-2-chloro-6-methylphenyl)-2-(2-chlorophenoxy)acetamide
CID 100828371
2-(2,4-dichloro-6-methylphenoxy)-N-(3,4-dimethoxyphenyl)acetamide
CID 1348476
N-(2-chloro-4,6-dimethylphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 109008811

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide?
The IUPAC name of N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide (CID 100829792) is N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide?
The canonical SMILES for N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide is COc1cc(N)cc(Cl)c1NC(=O)COc1c(C)cc(C)cc1Cl.
What is the InChIKey of N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide?
The InChIKey is MGLLXSYZMRVEPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O3/c1-9-4-10(2)17(13(19)5-9)24-8-15(22)21-16-12(18)6-11(20)7-14(16)23-3/h4-7H,8,20H2,1-3H3,(H,21,22).
What are the key properties of N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide?
N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide has a molecular weight of 369.25 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-chloro-6-methoxyphenyl)-2-(2-chloro-4,6-dimethylphenoxy)acetamide is sourced from PubChem (CID 100829792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).