N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide

C18H20BrNO2 — CID 113197623

IUPACN-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)Nc2ccc(C)cc2Br)cc1
InChIInChI=1S/C18H20BrNO2/c1-12-5-10-16(15(19)11-12)20-17(21)18(2,3)13-6-8-14(22-4)9-7-13/h5-11H,1-4H3,(H,20,21)
InChIKeySQOWTZVPAPINPT-UHFFFAOYSA-N
MW362.27 g/mol
LogP4.68
Rot. Bonds4

About N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide

N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 113197623) has the molecular formula C18H20BrNO2 and a molecular weight of 362.27 g/mol. Its IUPAC name is N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID113197623
Molecular FormulaC18H20BrNO2
Molecular Weight362.27 g/mol
Exact Mass361.07
IUPAC NameN-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)Nc2ccc(C)cc2Br)cc1
InChIInChI=1S/C18H20BrNO2/c1-12-5-10-16(15(19)11-12)20-17(21)18(2,3)13-6-8-14(22-4)9-7-13/h5-11H,1-4H3,(H,20,21)
InChIKeySQOWTZVPAPINPT-UHFFFAOYSA-N
XLogP4.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.27
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-methylphenyl)-2-(4-methoxyanilino)acetamide
CID 109009113
N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 113197625
N-(2-bromo-4-methylphenyl)-N'-(2,5-dimethoxyphenyl)oxamide
CID 108511999
N-(2-bromo-4-methylphenyl)-2-[(4-methoxyphenyl)methylamino]acetamide
CID 108998576
N-(2-bromo-4-methylphenyl)-2-hydroxy-5-methoxybenzamide
CID 60715660
N-(3-chloro-2-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438772
2-(3,4-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide
CID 110438702
N-(2-bromo-4-methylphenyl)-3-(2,4-dimethoxyanilino)propanamide
CID 109040499
N-(2-bromo-4-methylphenyl)-2-(3,5-dimethoxyphenoxy)acetamide
CID 7713871
N-(2-bromo-4-methylphenyl)-3-[(4-methoxyphenyl)methylamino]propanamide
CID 109022539
[2-(2-bromo-4-methylanilino)-2-oxoethyl]-[(4-methoxyphenyl)methyl]-methylazanium
CID 8761613
N-(3-acetamidophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438763

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide (CID 113197623) is N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(C(C)(C)C(=O)Nc2ccc(C)cc2Br)cc1.
What is the InChIKey of N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is SQOWTZVPAPINPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20BrNO2/c1-12-5-10-16(15(19)11-12)20-17(21)18(2,3)13-6-8-14(22-4)9-7-13/h5-11H,1-4H3,(H,20,21).
What are the key properties of N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide has a molecular weight of 362.27 g/mol, XLogP of 4.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 113197623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).