2-oxo-2-(4-propan-2-yloxyphenyl)acetamide

C11H13NO3 — CID 116924444

IUPAC2-oxo-2-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccc(C(=O)C(N)=O)cc1
InChIInChI=1S/C11H13NO3/c1-7(2)15-9-5-3-8(4-6-9)10(13)11(12)14/h3-7H,1-2H3,(H2,12,14)
InChIKeyVCZGWUSSIGKNQE-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.14
Rot. Bonds4

About 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide

2-oxo-2-(4-propan-2-yloxyphenyl)acetamide (PubChem CID 116924444) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-oxo-2-(4-propan-2-yloxyphenyl)acetamide
PubChem CID116924444
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name2-oxo-2-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccc(C(=O)C(N)=O)cc1
InChIInChI=1S/C11H13NO3/c1-7(2)15-9-5-3-8(4-6-9)10(13)11(12)14/h3-7H,1-2H3,(H2,12,14)
InChIKeyVCZGWUSSIGKNQE-UHFFFAOYSA-N
XLogP1.14
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

(4-propan-2-yloxybenzoyl)chloranium
CID 143172095
[[amino-(4-propan-2-yloxyphenyl)methylidene]amino] acetate
CID 123815247
fluoro 4-propan-2-yloxybenzoate
CID 174701102
2-bromo-1-(4-propan-2-yloxyphenyl)propan-1-one
CID 22111343
3-amino-1-(4-propan-2-yloxyphenyl)butan-1-one
CID 81463114
2,2,2-trifluoro-1-(4-propan-2-yloxyphenyl)ethanone
CID 62961699
2-methyl-3-oxo-3-(4-propan-2-yloxyphenyl)propanoic acid
CID 116918210
4-amino-1-(4-propan-2-yloxyphenyl)butan-1-one
CID 82341479
3-ethoxy-1-(4-propan-2-yloxyphenyl)propan-1-one
CID 105097425
[N'-(4-propan-2-yloxyphenyl)carbamimidoyl]urea
CID 136937293
4-propan-2-yloxy-N-[2-[(4-propan-2-yloxybenzoyl)amino]ethyl]benzamide
CID 4952415
4-amino-N-(4-propan-2-yloxyphenyl)benzamide
CID 28722589

Frequently Asked Questions

What is the IUPAC name of 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide (CID 116924444) is 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide is CC(C)Oc1ccc(C(=O)C(N)=O)cc1.
What is the InChIKey of 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide?
The InChIKey is VCZGWUSSIGKNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-7(2)15-9-5-3-8(4-6-9)10(13)11(12)14/h3-7H,1-2H3,(H2,12,14).
What are the key properties of 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide?
2-oxo-2-(4-propan-2-yloxyphenyl)acetamide has a molecular weight of 207.23 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-2-(4-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 116924444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).