N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide

C16H17ClN2O2 — CID 28867327

IUPACN-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide
SMILESCc1cccc(C)c1OCC(=O)Nc1ccc(Cl)cc1N
InChIInChI=1S/C16H17ClN2O2/c1-10-4-3-5-11(2)16(10)21-9-15(20)19-14-7-6-12(17)8-13(14)18/h3-8H,9,18H2,1-2H3,(H,19,20)
InChIKeyUHYMCRUJNDNRJS-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.56
Rot. Bonds4

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

N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide (PubChem CID 28867327) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide
PubChem CID28867327
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide
SMILESCc1cccc(C)c1OCC(=O)Nc1ccc(Cl)cc1N
InChIInChI=1S/C16H17ClN2O2/c1-10-4-3-5-11(2)16(10)21-9-15(20)19-14-7-6-12(17)8-13(14)18/h3-8H,9,18H2,1-2H3,(H,19,20)
InChIKeyUHYMCRUJNDNRJS-UHFFFAOYSA-N
XLogP3.56
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.56
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-(2-amino-4-bromophenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 91689015
N-(2-amino-4-chlorophenyl)-2-(2,4-dichloro-6-methylphenoxy)acetamide
CID 91689111
N-(5-chloro-2-hydroxyphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 838186
N-(2-amino-4-ethoxyphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 91689021
N-(2-amino-4-chlorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29045302
N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 2711364
N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 835994
N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide
CID 29050775
N-(2-amino-6-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 43376385
N-(2-amino-4-chlorophenyl)-2-ethoxyacetamide
CID 16791800
N-(2-amino-4-chlorophenyl)-2-(4-tert-butylphenoxy)acetamide
CID 91688991
2-(2-amino-6-chlorophenoxy)-N-(2-methylphenyl)acetamide
CID 107716023

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
The IUPAC name of N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide (CID 28867327) is N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
The canonical SMILES for N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide is Cc1cccc(C)c1OCC(=O)Nc1ccc(Cl)cc1N.
What is the InChIKey of N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
The InChIKey is UHYMCRUJNDNRJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-10-4-3-5-11(2)16(10)21-9-15(20)19-14-7-6-12(17)8-13(14)18/h3-8H,9,18H2,1-2H3,(H,19,20).
What are the key properties of N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide has a molecular weight of 304.78 g/mol, XLogP of 3.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide is sourced from PubChem (CID 28867327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).