N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide

C16H16Cl2N2O2 — CID 100828362

IUPACN-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide
SMILESCc1cc(OCC(=O)Nc2c(C)cc(N)cc2Cl)ccc1Cl
InChIInChI=1S/C16H16Cl2N2O2/c1-9-6-12(3-4-13(9)17)22-8-15(21)20-16-10(2)5-11(19)7-14(16)18/h3-7H,8,19H2,1-2H3,(H,20,21)
InChIKeyLVIXCNNEOUUYMM-UHFFFAOYSA-N
MW339.22 g/mol
LogP4.21
Rot. Bonds4

About N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide

N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide (PubChem CID 100828362) has the molecular formula C16H16Cl2N2O2 and a molecular weight of 339.22 g/mol. Its IUPAC name is N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide
PubChem CID100828362
Molecular FormulaC16H16Cl2N2O2
Molecular Weight339.22 g/mol
Exact Mass338.06
IUPAC NameN-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide
SMILESCc1cc(OCC(=O)Nc2c(C)cc(N)cc2Cl)ccc1Cl
InChIInChI=1S/C16H16Cl2N2O2/c1-9-6-12(3-4-13(9)17)22-8-15(21)20-16-10(2)5-11(19)7-14(16)18/h3-7H,8,19H2,1-2H3,(H,20,21)
InChIKeyLVIXCNNEOUUYMM-UHFFFAOYSA-N
XLogP4.21
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.22
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-2,6-dimethylphenyl)-2-(4-chlorophenoxy)acetamide
CID 50881036
N-(2-amino-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide
CID 43376738
N-(4-amino-2-chloro-6-methylphenyl)-2-(2-chlorophenoxy)acetamide
CID 100828371
2-(4-chloro-3-methylphenoxy)-N'-[2-(4-chloro-3-methylphenoxy)acetyl]acetohydrazide
CID 3554706
N-(4-amino-2-methylphenyl)-2-(3,4-dichlorophenoxy)acetamide
CID 60999929
N-(2-chloro-4,6-dimethylphenyl)-2-(3-chloro-4-fluorophenoxy)acetamide
CID 2534815
2-(4-chloro-3-methylphenoxy)-N-(2-hydroxynaphthalen-1-yl)acetamide
CID 8797487
2-(4-chloro-3-methylphenoxy)-N-pyridin-2-ylacetamide
CID 883765
N-(2-chloro-4,6-dimethylphenyl)-2-(3-methylphenoxy)acetamide
CID 19174206
N-(2-chloro-4,6-dimethylphenyl)-2-(4-iodophenoxy)acetamide
CID 24607292
2-(4-chloro-3-methylphenoxy)-N-(4-ethylphenyl)acetamide
CID 841196
N-(4-amino-2-bromo-6-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 100828316

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide?
The IUPAC name of N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide (CID 100828362) is N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide.
What is the SMILES notation for N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide?
The canonical SMILES for N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide is Cc1cc(OCC(=O)Nc2c(C)cc(N)cc2Cl)ccc1Cl.
What is the InChIKey of N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide?
The InChIKey is LVIXCNNEOUUYMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O2/c1-9-6-12(3-4-13(9)17)22-8-15(21)20-16-10(2)5-11(19)7-14(16)18/h3-7H,8,19H2,1-2H3,(H,20,21).
What are the key properties of N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide?
N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide has a molecular weight of 339.22 g/mol, XLogP of 4.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-chloro-6-methylphenyl)-2-(4-chloro-3-methylphenoxy)acetamide is sourced from PubChem (CID 100828362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).