2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

C18H20ClNO — CID 2165744

IUPAC2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILESCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C18H20ClNO/c1-12(2)16-6-4-5-13(3)18(16)20-17(21)11-14-7-9-15(19)10-8-14/h4-10,12H,11H2,1-3H3,(H,20,21)
InChIKeyBNOGXKPWKBVKSL-UHFFFAOYSA-N
MW301.82 g/mol
LogP4.95
Rot. Bonds4

About 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (PubChem CID 2165744) has the molecular formula C18H20ClNO and a molecular weight of 301.82 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
PubChem CID2165744
Molecular FormulaC18H20ClNO
Molecular Weight301.82 g/mol
Exact Mass301.12
IUPAC Name2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILESCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C18H20ClNO/c1-12(2)16-6-4-5-13(3)18(16)20-17(21)11-14-7-9-15(19)10-8-14/h4-10,12H,11H2,1-3H3,(H,20,21)
InChIKeyBNOGXKPWKBVKSL-UHFFFAOYSA-N
XLogP4.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-fluorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 7919869
2-(4-ethoxyphenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 51536149
2-[acetyl-[2-(4-chlorophenyl)ethyl]amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113165479
N-(3,5-dichlorophenyl)-N'-(2-methyl-6-propan-2-ylphenyl)propanediamide
CID 108954608
2-(2,3-dihydro-1H-inden-5-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 16556750
N-(2-methyl-6-propan-2-ylphenyl)-2-sulfanylacetamide
CID 715390
1-N-[(4-chlorophenyl)methyl]-1-N'-(2-methyl-6-propan-2-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108976096
2-(2,4-dimethylphenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 100755607
2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride
CID 119674500
2-[(4-chloro-2-fluorophenyl)methylsulfanyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 100719936
2-(furan-2-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 110484715
3-amino-N-(2-methyl-6-propan-2-ylphenyl)-3-sulfanylidenepropanamide
CID 28942450

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (CID 2165744) is 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is Cc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The InChIKey is BNOGXKPWKBVKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO/c1-12(2)16-6-4-5-13(3)18(16)20-17(21)11-14-7-9-15(19)10-8-14/h4-10,12H,11H2,1-3H3,(H,20,21).
What are the key properties of 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide has a molecular weight of 301.82 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 2165744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).