4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide

C20H25NO2 — CID 60599970

IUPAC4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide
SMILESCOCc1ccc(C(=O)NCC(C)(C)c2cccc(C)c2)cc1
InChIInChI=1S/C20H25NO2/c1-15-6-5-7-18(12-15)20(2,3)14-21-19(22)17-10-8-16(9-11-17)13-23-4/h5-12H,13-14H2,1-4H3,(H,21,22)
InChIKeySYXGZDCZBHLCBA-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.85
Rot. Bonds6

About 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide

4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide (PubChem CID 60599970) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide
PubChem CID60599970
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide
SMILESCOCc1ccc(C(=O)NCC(C)(C)c2cccc(C)c2)cc1
InChIInChI=1S/C20H25NO2/c1-15-6-5-7-18(12-15)20(2,3)14-21-19(22)17-10-8-16(9-11-17)13-23-4/h5-12H,13-14H2,1-4H3,(H,21,22)
InChIKeySYXGZDCZBHLCBA-UHFFFAOYSA-N
XLogP3.85
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[[2-methyl-2-(3-methylphenyl)propyl]carbamoyl]phenoxy]acetic acid
CID 138057931
N-[2-(4-methoxyphenyl)-2-methylpropyl]-3-methylbenzamide
CID 113090429
N-(2-amino-2-methylpropyl)-4-(methoxymethyl)benzamide;hydrochloride
CID 119629575
N-(4-hydroxy-2,2-dimethylbutyl)-4-(methoxymethyl)benzamide
CID 103772341
N-[2-(3-chlorophenyl)-2-methylpropyl]-3-methylbenzamide
CID 110441462
N-[2-methyl-2-(3-methylphenyl)propyl]carbamoyl bromide
CID 115194297
2-[3-[[2-methyl-2-(3-methylphenyl)propyl]carbamoyl]phenoxy]acetic acid
CID 119182911
4-(aminomethyl)-N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]benzamide
CID 119316502
2-(2-methoxyethylamino)-N-[2-methyl-2-(3-methylphenyl)propyl]acetamide;hydrochloride
CID 119757019
4-(aminomethyl)-N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]benzamide;hydrochloride
CID 119316501
4-(methoxymethyl)-N-[2-(methylamino)ethyl]benzamide
CID 119503363
potassium 2-(hydroxymethyl)-5-[[2-methyl-2-(3-methylphenyl)propyl]carbamoyl]benzoate
CID 167977502

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide?
The IUPAC name of 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide (CID 60599970) is 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide.
What is the SMILES notation for 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide?
The canonical SMILES for 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide is COCc1ccc(C(=O)NCC(C)(C)c2cccc(C)c2)cc1.
What is the InChIKey of 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide?
The InChIKey is SYXGZDCZBHLCBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-15-6-5-7-18(12-15)20(2,3)14-21-19(22)17-10-8-16(9-11-17)13-23-4/h5-12H,13-14H2,1-4H3,(H,21,22).
What are the key properties of 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide?
4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide has a molecular weight of 311.43 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-[2-methyl-2-(3-methylphenyl)propyl]benzamide is sourced from PubChem (CID 60599970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).