2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide

C24H26N2O3 — CID 55471442

IUPAC2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide
SMILESCOc1ccc(CN(C)C(C(=O)Nc2ccccc2)c2ccccc2)c(OC)c1
InChIInChI=1S/C24H26N2O3/c1-26(17-19-14-15-21(28-2)16-22(19)29-3)23(18-10-6-4-7-11-18)24(27)25-20-12-8-5-9-13-20/h4-16,23H,17H2,1-3H3,(H,25,27)
InChIKeyFEXUWKFTJUVQNL-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.52
Rot. Bonds8

About 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide

2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide (PubChem CID 55471442) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide.

Molecular Properties

Compound Name2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide
PubChem CID55471442
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide
SMILESCOc1ccc(CN(C)C(C(=O)Nc2ccccc2)c2ccccc2)c(OC)c1
InChIInChI=1S/C24H26N2O3/c1-26(17-19-14-15-21(28-2)16-22(19)29-3)23(18-10-6-4-7-11-18)24(27)25-20-12-8-5-9-13-20/h4-16,23H,17H2,1-3H3,(H,25,27)
InChIKeyFEXUWKFTJUVQNL-UHFFFAOYSA-N
XLogP4.52
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-(4-fluorophenyl)-2-phenylacetamide
CID 2689336
methyl 2-[(2,4-dimethoxyphenyl)methyl-(4-methoxybenzoyl)amino]-2-phenylacetate
CID 58997996
2-[(2-fluorophenyl)methyl-methylamino]-N,2-diphenylacetamide
CID 18124307
N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide
CID 55351620
(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide
CID 8845701
1-[(2,4-dimethoxyphenyl)methyl]-3-phenylurea
CID 110774912
(2S)-N-(2-methoxy-5-methylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide
CID 8516586
N-(3-methoxyphenyl)-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide
CID 4883661
N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-phenylacetamide
CID 16576213
(2,4-dimethoxyphenyl)methyl-methylcarbamic acid
CID 115170960
2-(2,4-dimethoxyphenyl)-N-[4-(1-phenylethylamino)phenyl]acetamide
CID 55986921
2-[[N-[(2,4-dimethoxyphenyl)methyl]-N,N'-dimethylcarbamimidoyl]amino]-N-phenylacetamide;hydroiodide
CID 111296334

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide?
The IUPAC name of 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide (CID 55471442) is 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide.
What is the SMILES notation for 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide?
The canonical SMILES for 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide is COc1ccc(CN(C)C(C(=O)Nc2ccccc2)c2ccccc2)c(OC)c1.
What is the InChIKey of 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide?
The InChIKey is FEXUWKFTJUVQNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-26(17-19-14-15-21(28-2)16-22(19)29-3)23(18-10-6-4-7-11-18)24(27)25-20-12-8-5-9-13-20/h4-16,23H,17H2,1-3H3,(H,25,27).
What are the key properties of 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide?
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide has a molecular weight of 390.48 g/mol, XLogP of 4.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide is sourced from PubChem (CID 55471442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).