2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide

C22H26N2O4 — CID 34729772

IUPAC2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)Nc1ccccc1C(=O)NCC(C)C
InChIInChI=1S/C22H26N2O4/c1-14(2)13-23-22(27)18-7-5-6-8-19(18)24-21(26)12-17-11-16(15(3)25)9-10-20(17)28-4/h5-11,14H,12-13H2,1-4H3,(H,23,27)(H,24,26)
InChIKeyDQZYSNGWRHBFGK-UHFFFAOYSA-N
MW382.46 g/mol
LogP3.46
Rot. Bonds8

About 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide

2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide (PubChem CID 34729772) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
PubChem CID34729772
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC Name2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)Nc1ccccc1C(=O)NCC(C)C
InChIInChI=1S/C22H26N2O4/c1-14(2)13-23-22(27)18-7-5-6-8-19(18)24-21(26)12-17-11-16(15(3)25)9-10-20(17)28-4/h5-11,14H,12-13H2,1-4H3,(H,23,27)(H,24,26)
InChIKeyDQZYSNGWRHBFGK-UHFFFAOYSA-N
XLogP3.46
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethoxy-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide
CID 18089928
2-[[2-(2,5-dimethoxyphenyl)acetyl]amino]-N-propan-2-ylbenzamide
CID 78865415
N-(3,4-dimethoxyphenyl)-2-(2-methylpropylcarbamoylamino)benzamide
CID 110609641
2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide
CID 17427408
2-(5-acetyl-2-methoxyphenyl)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120830590
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dimethoxyphenyl)acetamide
CID 16557440
[4-[[2-(2-methylpropylcarbamoyl)phenyl]carbamoyl]phenyl] acetate
CID 1369781
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(2-methylpropyl)benzamide
CID 31324729
2-[[4-(3,4-dimethylphenyl)-4-oxobutanoyl]amino]-N-(2-methylpropyl)benzamide
CID 34731957
2-(butanoylamino)-N-(2-methylpropyl)benzamide
CID 37034782
2-(5-acetyl-2-methoxyphenyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 30843339
[2-[2-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 31127487

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
The IUPAC name of 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide (CID 34729772) is 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide is COc1ccc(C(C)=O)cc1CC(=O)Nc1ccccc1C(=O)NCC(C)C.
What is the InChIKey of 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
The InChIKey is DQZYSNGWRHBFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-14(2)13-23-22(27)18-7-5-6-8-19(18)24-21(26)12-17-11-16(15(3)25)9-10-20(17)28-4/h5-11,14H,12-13H2,1-4H3,(H,23,27)(H,24,26).
What are the key properties of 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide has a molecular weight of 382.46 g/mol, XLogP of 3.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 34729772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).