2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide

C10H10Cl2FNO — CID 166409215

IUPAC2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide
SMILESO=C(CCl)NCCc1cccc(Cl)c1F
InChIInChI=1S/C10H10Cl2FNO/c11-6-9(15)14-5-4-7-2-1-3-8(12)10(7)13/h1-3H,4-6H2,(H,14,15)
InChIKeyKBAWCCLTJDTWRC-UHFFFAOYSA-N
MW250.10 g/mol
LogP2.38
Rot. Bonds4

About 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide

2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide (PubChem CID 166409215) has the molecular formula C10H10Cl2FNO and a molecular weight of 250.10 g/mol. Its IUPAC name is 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide
PubChem CID166409215
Molecular FormulaC10H10Cl2FNO
Molecular Weight250.10 g/mol
Exact Mass249.01
IUPAC Name2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide
SMILESO=C(CCl)NCCc1cccc(Cl)c1F
InChIInChI=1S/C10H10Cl2FNO/c11-6-9(15)14-5-4-7-2-1-3-8(12)10(7)13/h1-3H,4-6H2,(H,14,15)
InChIKeyKBAWCCLTJDTWRC-UHFFFAOYSA-N
XLogP2.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.10
LogP ≤ 52.38
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

N-[2-(3-bromo-2-chlorophenyl)ethyl]-2-chloroacetamide
CID 166431390
2-chloro-N-[2-(2-ethylphenyl)ethyl]acetamide
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3-amino-N-[2-(2-chlorophenyl)ethyl]propanamide
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2-(3-chloro-2-fluorophenyl)acetamide
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2-[(3-chloro-2-fluorophenyl)methylamino]-N-(2-methoxyethyl)acetamide
CID 115695765
N-[2-(2-chloro-6-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 71917928
1-chloro-3-(3-chloropropyl)-2-fluorobenzene
CID 53434110
[2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] 2-chloro-6-fluorobenzoate
CID 9007208
1-(2,6-dichlorophenyl)-3-[2-(2-fluorophenyl)ethyl]urea
CID 108900131
N-[(3-chloro-2-fluorophenyl)methyl]pentanamide
CID 156569845
N-[2-(2-chlorophenyl)ethyl]-2-isocyanoacetamide
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1-chloro-3-(4-chlorobutyl)-2-fluorobenzene
CID 102862230

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide (CID 166409215) is 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide is O=C(CCl)NCCc1cccc(Cl)c1F.
What is the InChIKey of 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide?
The InChIKey is KBAWCCLTJDTWRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2FNO/c11-6-9(15)14-5-4-7-2-1-3-8(12)10(7)13/h1-3H,4-6H2,(H,14,15).
What are the key properties of 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide?
2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide has a molecular weight of 250.10 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(3-chloro-2-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 166409215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).