2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide

C19H23NO3 — CID 113091742

IUPAC2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide
SMILESCOc1ccc(CC(=O)NC(C)(C)c2ccccc2)cc1OC
InChIInChI=1S/C19H23NO3/c1-19(2,15-8-6-5-7-9-15)20-18(21)13-14-10-11-16(22-3)17(12-14)23-4/h5-12H,13H2,1-4H3,(H,20,21)
InChIKeySYCHTHIFDJHUOC-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.30
Rot. Bonds6

About 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide

2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide (PubChem CID 113091742) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide
PubChem CID113091742
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide
SMILESCOc1ccc(CC(=O)NC(C)(C)c2ccccc2)cc1OC
InChIInChI=1S/C19H23NO3/c1-19(2,15-8-6-5-7-9-15)20-18(21)13-14-10-11-16(22-3)17(12-14)23-4/h5-12H,13H2,1-4H3,(H,20,21)
InChIKeySYCHTHIFDJHUOC-UHFFFAOYSA-N
XLogP3.30
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)propan-2-yl]acetamide
CID 113091536
2-(3,4-dimethoxyphenyl)-N-[(2S)-3,3,3-trifluoro-2-hydroxy-2-phenylpropyl]acetamide
CID 95376510
2-(4-fluorophenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 13118330
2-(3-chlorophenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 13118326
2-(3,4-dimethoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82725203
2-(3,4-dimethoxyphenyl)-N-(2-methylphenyl)acetamide
CID 835508
2-(3,4-dimethoxyphenyl)-N-[3-(hydroxymethyl)pentan-3-yl]acetamide
CID 62517073
N-(4-tert-butylphenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 7741769
2-amino-N-[2-(3,4-dimethoxyphenyl)propan-2-yl]acetamide
CID 110459405
phenyl N-[2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]ethyl]carbamate
CID 108575202
N-[2-(3,4-dimethoxyphenyl)propan-2-yl]-2-(methylamino)acetamide
CID 110460450
N-[2-(3,4-dimethoxyphenyl)propan-2-yl]butanamide
CID 113091518

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide (CID 113091742) is 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide is COc1ccc(CC(=O)NC(C)(C)c2ccccc2)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide?
The InChIKey is SYCHTHIFDJHUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-19(2,15-8-6-5-7-9-15)20-18(21)13-14-10-11-16(22-3)17(12-14)23-4/h5-12H,13H2,1-4H3,(H,20,21).
What are the key properties of 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide?
2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide has a molecular weight of 313.40 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide is sourced from PubChem (CID 113091742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).