2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide

C16H21Cl2NO — CID 22076137

IUPAC2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide
SMILESCCC1CCC(NC(=O)Cc2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C16H21Cl2NO/c1-2-11-6-8-12(9-7-11)19-16(20)10-13-14(17)4-3-5-15(13)18/h3-5,11-12H,2,6-10H2,1H3,(H,19,20)
InChIKeyZZKHFYXWTIYTSG-UHFFFAOYSA-N
MW314.26 g/mol
LogP4.62
Rot. Bonds4

About 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide

2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide (PubChem CID 22076137) has the molecular formula C16H21Cl2NO and a molecular weight of 314.26 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide
PubChem CID22076137
Molecular FormulaC16H21Cl2NO
Molecular Weight314.26 g/mol
Exact Mass313.10
IUPAC Name2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide
SMILESCCC1CCC(NC(=O)Cc2c(Cl)cccc2Cl)CC1
InChIInChI=1S/C16H21Cl2NO/c1-2-11-6-8-12(9-7-11)19-16(20)10-13-14(17)4-3-5-15(13)18/h3-5,11-12H,2,6-10H2,1H3,(H,19,20)
InChIKeyZZKHFYXWTIYTSG-UHFFFAOYSA-N
XLogP4.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.26
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopropyl-2-(2,6-dichlorophenyl)acetamide
CID 2682749
N-(4-tert-butylcyclohexyl)-2-(2,6-dichlorophenyl)acetamide;carbonic acid
CID 22076151
N-[(2,6-dichlorophenyl)methyl]-4-ethylcyclohexan-1-amine
CID 63454775
N-(4-chlorocyclohexyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 114297195
2-(2-chloro-4-methoxyphenyl)-N-(4-ethylcyclohexyl)acetamide
CID 69042089
2-[2-(aminomethyl)phenyl]-N-(4-ethylcyclohexyl)acetamide
CID 81321943
N'-(3-chloro-2-methylphenyl)-N-(4-ethylcyclohexyl)oxamide
CID 124670787
2-(2-chloro-6-fluorophenyl)-N-cyclohexylacetamide
CID 974091
2-(2-chloro-6-methoxyphenyl)-N-cyclohexylacetamide
CID 69037841
2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-ethylcyclohexyl)acetamide
CID 112816529
N-(4-tert-butylcyclohexyl)-2-(2-chloro-6-fluorophenyl)acetamide;carbonic acid
CID 22076120
2-(2,6-dichlorophenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 55705364

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide (CID 22076137) is 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide is CCC1CCC(NC(=O)Cc2c(Cl)cccc2Cl)CC1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide?
The InChIKey is ZZKHFYXWTIYTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21Cl2NO/c1-2-11-6-8-12(9-7-11)19-16(20)10-13-14(17)4-3-5-15(13)18/h3-5,11-12H,2,6-10H2,1H3,(H,19,20).
What are the key properties of 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide?
2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide has a molecular weight of 314.26 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-(4-ethylcyclohexyl)acetamide is sourced from PubChem (CID 22076137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).