2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide

C19H24N2O3 — CID 8786291

IUPAC2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide
SMILESCOc1ccc(OC)c(CN(C)CC(=O)Nc2ccc(C)cc2)c1
InChIInChI=1S/C19H24N2O3/c1-14-5-7-16(8-6-14)20-19(22)13-21(2)12-15-11-17(23-3)9-10-18(15)24-4/h5-11H,12-13H2,1-4H3,(H,20,22)
InChIKeyULPHYGCIAWZVRV-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.08
Rot. Bonds7

About 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide

2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide (PubChem CID 8786291) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide
PubChem CID8786291
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide
SMILESCOc1ccc(OC)c(CN(C)CC(=O)Nc2ccc(C)cc2)c1
InChIInChI=1S/C19H24N2O3/c1-14-5-7-16(8-6-14)20-19(22)13-21(2)12-15-11-17(23-3)9-10-18(15)24-4/h5-11H,12-13H2,1-4H3,(H,20,22)
InChIKeyULPHYGCIAWZVRV-UHFFFAOYSA-N
XLogP3.08
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 8641843
methyl 4-[[2-[(2-methoxy-5-methylphenyl)methyl-methylamino]acetyl]amino]benzoate
CID 8805335
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(4-methylphenyl)acetamide
CID 34978448
N-(4-acetylphenyl)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]acetamide
CID 9101527
N-(4-tert-butylphenyl)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]acetamide
CID 9101281
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2698960
2-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(4-ethoxyphenyl)acetamide
CID 9136541
2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-N-(phenylcarbamoyl)acetamide
CID 26647351
2-(2,5-dimethoxy-N-methylsulfonylanilino)-N-(4-methylphenyl)acetamide
CID 1099912
2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 8805849
2-(N-acetyl-2,4-dimethoxyanilino)-N-(4-methylphenyl)acetamide
CID 113174733
2-[(2,5-dimethoxyphenyl)methylsulfonylamino]-N-(4-methylphenyl)acetamide
CID 22300235

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide (CID 8786291) is 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide is COc1ccc(OC)c(CN(C)CC(=O)Nc2ccc(C)cc2)c1.
What is the InChIKey of 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide?
The InChIKey is ULPHYGCIAWZVRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-14-5-7-16(8-6-14)20-19(22)13-21(2)12-15-11-17(23-3)9-10-18(15)24-4/h5-11H,12-13H2,1-4H3,(H,20,22).
What are the key properties of 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide?
2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide has a molecular weight of 328.41 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethoxyphenyl)methyl-methylamino]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 8786291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).