2-chloro-N-ethyl-2-(2-methylphenyl)acetamide

C11H14ClNO — CID 62225126

IUPAC2-chloro-N-ethyl-2-(2-methylphenyl)acetamide
SMILESCCNC(=O)C(Cl)c1ccccc1C
InChIInChI=1S/C11H14ClNO/c1-3-13-11(14)10(12)9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3,(H,13,14)
InChIKeyQDWNLERFZCOXAY-UHFFFAOYSA-N
MW211.69 g/mol
LogP2.41
Rot. Bonds3

About 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide

2-chloro-N-ethyl-2-(2-methylphenyl)acetamide (PubChem CID 62225126) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-2-(2-methylphenyl)acetamide
PubChem CID62225126
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name2-chloro-N-ethyl-2-(2-methylphenyl)acetamide
SMILESCCNC(=O)C(Cl)c1ccccc1C
InChIInChI=1S/C11H14ClNO/c1-3-13-11(14)10(12)9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3,(H,13,14)
InChIKeyQDWNLERFZCOXAY-UHFFFAOYSA-N
XLogP2.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-2-(2-methylphenyl)-N-propylacetamide
CID 62224578
2-chloro-2-(2-methylphenyl)-N-propan-2-ylacetamide
CID 62224401
2-chloro-2-(2-methylphenyl)acetic acid
CID 23338325
2-chloro-N-cyclohexyl-2-(2-methylphenyl)acetamide
CID 62226466
2-chloro-2-(2,5-dimethoxyphenyl)-N-ethylacetamide
CID 62226434
2-chloro-2-(3-chloro-4-methylphenyl)-N-ethylacetamide
CID 106818458
2-chloro-2-(1,5-dimethylpyrazol-4-yl)-N-ethylacetamide
CID 79584700
N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylbenzamide
CID 42908748
2-chloro-2-(2-fluoro-3-methylphenyl)-N-methylacetamide
CID 130992769
N-ethyl-2-hydroxy-3-phenylpropanamide
CID 13215108
2-chloro-N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)acetamide
CID 112671060
N-[2-[[ethylamino-[1-(2-methylphenyl)ethylamino]methylidene]amino]ethyl]-2-methylpropanamide
CID 111321960

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide?
The IUPAC name of 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide (CID 62225126) is 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide?
The canonical SMILES for 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide is CCNC(=O)C(Cl)c1ccccc1C.
What is the InChIKey of 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide?
The InChIKey is QDWNLERFZCOXAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-3-13-11(14)10(12)9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3,(H,13,14).
What are the key properties of 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide?
2-chloro-N-ethyl-2-(2-methylphenyl)acetamide has a molecular weight of 211.69 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 62225126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).