4-(2,2-dimethylpropanoyl)benzamide

C12H15NO2 — CID 10536234

IUPAC4-(2,2-dimethylpropanoyl)benzamide
SMILESCC(C)(C)C(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C12H15NO2/c1-12(2,3)10(14)8-4-6-9(7-5-8)11(13)15/h4-7H,1-3H3,(H2,13,15)
InChIKeyYVJNRRUMRWRMMZ-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.01
Rot. Bonds2

About 4-(2,2-dimethylpropanoyl)benzamide

4-(2,2-dimethylpropanoyl)benzamide (PubChem CID 10536234) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 4-(2,2-dimethylpropanoyl)benzamide.

Molecular Properties

Compound Name4-(2,2-dimethylpropanoyl)benzamide
PubChem CID10536234
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name4-(2,2-dimethylpropanoyl)benzamide
SMILESCC(C)(C)C(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C12H15NO2/c1-12(2,3)10(14)8-4-6-9(7-5-8)11(13)15/h4-7H,1-3H3,(H2,13,15)
InChIKeyYVJNRRUMRWRMMZ-UHFFFAOYSA-N
XLogP2.01
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylpropanoyl)benzamide?
The IUPAC name of 4-(2,2-dimethylpropanoyl)benzamide (CID 10536234) is 4-(2,2-dimethylpropanoyl)benzamide.
What is the SMILES notation for 4-(2,2-dimethylpropanoyl)benzamide?
The canonical SMILES for 4-(2,2-dimethylpropanoyl)benzamide is CC(C)(C)C(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-(2,2-dimethylpropanoyl)benzamide?
The InChIKey is YVJNRRUMRWRMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-12(2,3)10(14)8-4-6-9(7-5-8)11(13)15/h4-7H,1-3H3,(H2,13,15).
What are the key properties of 4-(2,2-dimethylpropanoyl)benzamide?
4-(2,2-dimethylpropanoyl)benzamide has a molecular weight of 205.26 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylpropanoyl)benzamide is sourced from PubChem (CID 10536234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).