N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide

C18H20BrNO2 — CID 113197625

IUPACN-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)Nc2ccc(Br)c(C)c2)cc1
InChIInChI=1S/C18H20BrNO2/c1-12-11-14(7-10-16(12)19)20-17(21)18(2,3)13-5-8-15(22-4)9-6-13/h5-11H,1-4H3,(H,20,21)
InChIKeyNYJCBZMVIJBSLJ-UHFFFAOYSA-N
MW362.27 g/mol
LogP4.68
Rot. Bonds4

About N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide

N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 113197625) has the molecular formula C18H20BrNO2 and a molecular weight of 362.27 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID113197625
Molecular FormulaC18H20BrNO2
Molecular Weight362.27 g/mol
Exact Mass361.07
IUPAC NameN-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)Nc2ccc(Br)c(C)c2)cc1
InChIInChI=1S/C18H20BrNO2/c1-12-11-14(7-10-16(12)19)20-17(21)18(2,3)13-5-8-15(22-4)9-6-13/h5-11H,1-4H3,(H,20,21)
InChIKeyNYJCBZMVIJBSLJ-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-(4-bromo-3-methylphenyl)-4-methoxybenzamide
CID 710659
N-(3-acetamidophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438763
2-(4-methoxyphenyl)-2-methyl-N-(2-methyl-4-pyridinyl)propanamide
CID 110439571
N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 113197623
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438737
2-(4-bromo-3-methylanilino)-N-(4-methoxyphenyl)acetamide
CID 9099464
2-(4-methoxyphenyl)-2-methyl-N-(4-propan-2-ylphenyl)propanamide
CID 113197616
1-(4-bromo-3-methylphenyl)-3-(3,5-dimethoxyphenyl)urea
CID 108869555
N-(4-bromo-3-methylphenyl)-2-methyl-2-(methylamino)propanamide
CID 62834851
N-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438804
N-(2-tert-butyl-4-pyridinyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110446407
2-(3,5-dimethoxyphenyl)-N-[4-[[2-(3,5-dimethoxyphenyl)-2-methylpropanoyl]amino]phenyl]-2-methylpropanamide
CID 67082899

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide (CID 113197625) is N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(C(C)(C)C(=O)Nc2ccc(Br)c(C)c2)cc1.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is NYJCBZMVIJBSLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20BrNO2/c1-12-11-14(7-10-16(12)19)20-17(21)18(2,3)13-5-8-15(22-4)9-6-13/h5-11H,1-4H3,(H,20,21).
What are the key properties of N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
N-(4-bromo-3-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-(4-bromo-3-methylphenyl)-2-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 113197625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).