2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide

C18H21NO3 — CID 113091730

IUPAC2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide
SMILESCOc1cccc(OC)c1C(=O)NC(C)(C)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-18(2,13-9-6-5-7-10-13)19-17(20)16-14(21-3)11-8-12-15(16)22-4/h5-12H,1-4H3,(H,19,20)
InChIKeyDUACRBPHOOLPRY-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.37
Rot. Bonds5

About 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide

2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide (PubChem CID 113091730) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide
PubChem CID113091730
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide
SMILESCOc1cccc(OC)c1C(=O)NC(C)(C)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-18(2,13-9-6-5-7-10-13)19-17(20)16-14(21-3)11-8-12-15(16)22-4/h5-12H,1-4H3,(H,19,20)
InChIKeyDUACRBPHOOLPRY-UHFFFAOYSA-N
XLogP3.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2,6-dimethoxybenzamide
CID 106180680
N-(1-bromo-2-methylpropan-2-yl)-2,6-dimethoxybenzamide
CID 113274115
4-[(2,6-dimethoxybenzoyl)amino]-4-methylpentanoic acid
CID 62041534
2-phenylpropan-2-ylcarbamic acid
CID 23445609
2-(3,4-dimethoxyphenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 113091742
2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide
CID 47444747
2,6-dimethoxybenzohydrazide
CID 2806104
2-iodo-N-(2-phenylpropan-2-yl)benzamide
CID 47444713
N-(2-phenylpropan-2-yl)-4-(trifluoromethyl)benzamide
CID 113091749
4-bromo-N-(2-phenylpropan-2-yl)benzamide
CID 47444769
2-methoxy-N-(2-phenylbutan-2-yl)benzamide
CID 86899366
methyl 2-(2-phenylpropan-2-ylcarbamoylamino)acetate
CID 110490508

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide?
The IUPAC name of 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide (CID 113091730) is 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide?
The canonical SMILES for 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide is COc1cccc(OC)c1C(=O)NC(C)(C)c1ccccc1.
What is the InChIKey of 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide?
The InChIKey is DUACRBPHOOLPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-18(2,13-9-6-5-7-10-13)19-17(20)16-14(21-3)11-8-12-15(16)22-4/h5-12H,1-4H3,(H,19,20).
What are the key properties of 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide?
2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide has a molecular weight of 299.37 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide is sourced from PubChem (CID 113091730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).