2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide

C17H25NO2 — CID 22946327

IUPAC2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide
SMILESCC(=O)c1c(C)c(C)c(C)c(C)c1C(=O)NCC(C)C
InChIInChI=1S/C17H25NO2/c1-9(2)8-18-17(20)16-13(6)11(4)10(3)12(5)15(16)14(7)19/h9H,8H2,1-7H3,(H,18,20)
InChIKeySQEOZYLMDPEYEP-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.51
Rot. Bonds4

About 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide

2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide (PubChem CID 22946327) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide
PubChem CID22946327
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide
SMILESCC(=O)c1c(C)c(C)c(C)c(C)c1C(=O)NCC(C)C
InChIInChI=1S/C17H25NO2/c1-9(2)8-18-17(20)16-13(6)11(4)10(3)12(5)15(16)14(7)19/h9H,8H2,1-7H3,(H,18,20)
InChIKeySQEOZYLMDPEYEP-UHFFFAOYSA-N
XLogP3.51
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,4,6-tetramethyl-N-(2-methylpropyl)benzamide
CID 123912379
4,6-dimethyl-N-(2-methylpropyl)pyrimidine-5-carboxamide
CID 110848394
2-hydroxy-3-[(2,3,4,5,6-pentamethylbenzoyl)amino]propanoic acid
CID 66168135
N-(2,3-dihydroxypropyl)-2,3,4,5,6-pentamethylbenzamide
CID 66176629
N-(2-cyclopropyl-2-hydroxyethyl)-2,3,4,5,6-pentamethylbenzamide
CID 63294856
ethane;N-(2-methylpropyl)acetamide
CID 142232237
6-methoxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide
CID 20767927
5-methyl-N-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
CID 130703712
6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide
CID 22143555
1-(4-chlorophenyl)-3,5-dimethyl-N-(2-methylpropyl)pyrazole-4-carboxamide
CID 24712291
5-methyl-N-(2-methylpropyl)furan-2-carboxamide
CID 3644011
2,5-dimethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
CID 110465467

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide?
The IUPAC name of 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide (CID 22946327) is 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide?
The canonical SMILES for 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide is CC(=O)c1c(C)c(C)c(C)c(C)c1C(=O)NCC(C)C.
What is the InChIKey of 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide?
The InChIKey is SQEOZYLMDPEYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-9(2)8-18-17(20)16-13(6)11(4)10(3)12(5)15(16)14(7)19/h9H,8H2,1-7H3,(H,18,20).
What are the key properties of 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide?
2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide has a molecular weight of 275.39 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-3,4,5,6-tetramethyl-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 22946327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).