N-(2-propan-2-ylphenyl)acetamide

C11H15NO — CID 2736684

IUPACN-(2-propan-2-ylphenyl)acetamide
SMILESCC(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C11H15NO/c1-8(2)10-6-4-5-7-11(10)12-9(3)13/h4-8H,1-3H3,(H,12,13)
InChIKeyPTHQJQDKJOVFRD-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.77
Rot. Bonds2

About N-(2-propan-2-ylphenyl)acetamide

N-(2-propan-2-ylphenyl)acetamide (PubChem CID 2736684) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-propan-2-ylphenyl)acetamide
PubChem CID2736684
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC NameN-(2-propan-2-ylphenyl)acetamide
SMILESCC(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C11H15NO/c1-8(2)10-6-4-5-7-11(10)12-9(3)13/h4-8H,1-3H3,(H,12,13)
InChIKeyPTHQJQDKJOVFRD-UHFFFAOYSA-N
XLogP2.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of N-(2-propan-2-ylphenyl)acetamide (CID 2736684) is N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for N-(2-propan-2-ylphenyl)acetamide is CC(=O)Nc1ccccc1C(C)C.
What is the InChIKey of N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is PTHQJQDKJOVFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-8(2)10-6-4-5-7-11(10)12-9(3)13/h4-8H,1-3H3,(H,12,13).
What are the key properties of N-(2-propan-2-ylphenyl)acetamide?
N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 177.25 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 2736684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).