N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide

C18H21NO2 — CID 2270387

IUPACN-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide
SMILESCOc1ccc(CC(C)(C)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C18H21NO2/c1-18(2,13-14-9-11-16(21-3)12-10-14)19-17(20)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3,(H,19,20)
InChIKeyPYALYNJEXBJOQE-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.45
Rot. Bonds5

About N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide

N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide (PubChem CID 2270387) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide
PubChem CID2270387
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide
SMILESCOc1ccc(CC(C)(C)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C18H21NO2/c1-18(2,13-14-9-11-16(21-3)12-10-14)19-17(20)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3,(H,19,20)
InChIKeyPYALYNJEXBJOQE-UHFFFAOYSA-N
XLogP3.45
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-2-[(4-methoxyphenyl)methylsulfanyl]-4-oxo-1-phenylbutan-2-yl]benzamide
CID 56625272
N-(2-methyl-1-phenylpropan-2-yl)-4-(2-phenylsulfanylethoxy)benzamide
CID 100728980
N-[1,1,1,3,3,3-hexafluoro-2-(4-methoxyanilino)propan-2-yl]benzamide
CID 570257
N-(2-methyl-1-phenylpropan-2-yl)-4-nitrobenzamide
CID 84568314
N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041752
3-benzyl-4-(4-methoxyphenyl)-3-methylbutanoic acid
CID 18624156
N-(1-bromo-2-methylpropan-2-yl)benzamide
CID 114308136
N-[dideuterio-(4-methoxyphenyl)methoxy]benzamide
CID 10038175
(4-methoxyphenyl) 2-benzamidoacetate
CID 23275662
3,4,5-trimethoxy-N-[2-methyl-1-(4-methylphenyl)propan-2-yl]benzamide
CID 110601722
2-methoxy-N-(2-methyl-1-phenylpropan-2-yl)acetamide
CID 84570069
3-methoxy-N-(2-methylbutan-2-yl)benzamide
CID 5204623

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide?
The IUPAC name of N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide (CID 2270387) is N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide is COc1ccc(CC(C)(C)NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide?
The InChIKey is PYALYNJEXBJOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-18(2,13-14-9-11-16(21-3)12-10-14)19-17(20)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3,(H,19,20).
What are the key properties of N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide?
N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide has a molecular weight of 283.37 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]benzamide is sourced from PubChem (CID 2270387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).