N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide

C16H15Cl2NO — CID 2713411

IUPACN-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H15Cl2NO/c17-14-7-6-13(15(18)11-14)8-9-19-16(20)10-12-4-2-1-3-5-12/h1-7,11H,8-10H2,(H,19,20)
InChIKeyPMUNGEXRJIGIMI-UHFFFAOYSA-N
MW308.21 g/mol
LogP3.89
Rot. Bonds5

About N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide

N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide (PubChem CID 2713411) has the molecular formula C16H15Cl2NO and a molecular weight of 308.21 g/mol. Its IUPAC name is N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide
PubChem CID2713411
Molecular FormulaC16H15Cl2NO
Molecular Weight308.21 g/mol
Exact Mass307.05
IUPAC NameN-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H15Cl2NO/c17-14-7-6-13(15(18)11-14)8-9-19-16(20)10-12-4-2-1-3-5-12/h1-7,11H,8-10H2,(H,19,20)
InChIKeyPMUNGEXRJIGIMI-UHFFFAOYSA-N
XLogP3.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide?
The IUPAC name of N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide (CID 2713411) is N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide is O=C(Cc1ccccc1)NCCc1ccc(Cl)cc1Cl.
What is the InChIKey of N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide?
The InChIKey is PMUNGEXRJIGIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO/c17-14-7-6-13(15(18)11-14)8-9-19-16(20)10-12-4-2-1-3-5-12/h1-7,11H,8-10H2,(H,19,20).
What are the key properties of N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide?
N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide has a molecular weight of 308.21 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dichlorophenyl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 2713411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).