N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide

C19H23ClN2O3 — CID 54827342

IUPACN-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
SMILESCCOCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C19H23ClN2O3/c1-3-24-11-12-25-18-10-5-4-8-17(18)21-13-19(23)22-16-9-6-7-15(20)14(16)2/h4-10,21H,3,11-13H2,1-2H3,(H,22,23)
InChIKeyHLJJZKIEZKWQFK-UHFFFAOYSA-N
MW362.86 g/mol
LogP4.11
Rot. Bonds9

About N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide

N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide (PubChem CID 54827342) has the molecular formula C19H23ClN2O3 and a molecular weight of 362.86 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
PubChem CID54827342
Molecular FormulaC19H23ClN2O3
Molecular Weight362.86 g/mol
Exact Mass362.14
IUPAC NameN-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
SMILESCCOCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C19H23ClN2O3/c1-3-24-11-12-25-18-10-5-4-8-17(18)21-13-19(23)22-16-9-6-7-15(20)14(16)2/h4-10,21H,3,11-13H2,1-2H3,(H,22,23)
InChIKeyHLJJZKIEZKWQFK-UHFFFAOYSA-N
XLogP4.11
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827691
N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide
CID 9101959
N-[2-(2-ethoxyethoxy)phenyl]-2-(2-methoxyanilino)acetamide
CID 54817500
N-(3,5-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827277
N-(3-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955086
N-[2-(2-ethoxyethoxy)phenyl]-2-(2-phenylmethoxyanilino)acetamide
CID 54827988
2-[2-(2-ethoxyethoxy)anilino]-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54827379
N-[(3-chloro-2-methylphenyl)carbamothioyl]-2-(2-ethoxyethoxy)benzamide
CID 17122972
2-(3-chloro-2-methylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54812960
2-(3-acetamidoanilino)-N-[2-(2-ethoxyethoxy)phenyl]acetamide
CID 54831775
2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
CID 17134034
N-[2-(2-chlorophenoxy)ethyl]-2-(2-ethoxyethoxy)aniline
CID 54801723

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide (CID 54827342) is N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide is CCOCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1C.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
The InChIKey is HLJJZKIEZKWQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3/c1-3-24-11-12-25-18-10-5-4-8-17(18)21-13-19(23)22-16-9-6-7-15(20)14(16)2/h4-10,21H,3,11-13H2,1-2H3,(H,22,23).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide has a molecular weight of 362.86 g/mol, XLogP of 4.11, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide is sourced from PubChem (CID 54827342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).